NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 G 3.9496 8.3544 109.7652 45.4675 0.0000 173.4325 -1 S 4.6299 7.8447 116.6084 55.6671 66.9915 173.3842 0 M 4.4016 8.9860 128.0193 58.3351 32.2732 178.5158 1 A 4.2062 8.1294 120.8924 54.8018 18.6020 179.5759 2 G 3.5248 8.0018 104.4624 48.0276 0.0000 176.0131 3 W 4.3850 8.4730 121.9390 59.2169 28.9533 178.6136 4 Q 4.1241 8.3958 119.8219 59.3416 28.3333 178.2550 5 S 4.1528 8.1278 115.1503 61.7169 63.2741 175.7650 6 Y 4.4467 8.2414 122.0522 61.1294 38.6329 178.8288 7 V 3.6839 8.1772 113.1811 64.3479 31.6920 178.2778 8 D 4.4764 8.5180 118.7082 56.9776 40.5581 178.2718 9 N 4.2818 7.8602 117.2169 56.4290 38.1479 177.0849 10 L 4.0717 7.9650 119.7117 57.2306 41.4714 178.5686 11 M 4.2624 7.7893 117.0026 56.5412 32.3226 177.0824 12 C 4.4231 7.7092 115.6509 60.2360 28.8129 174.9021 13 D 4.4194 7.3539 119.9300 58.4823 41.0180 176.0297 14 G 4.1435 8.3726 107.0745 46.3235 0.0000 173.9914 15 C 4.4692 9.0078 115.0234 57.6971 41.9844 172.7451 16 C 5.7205 7.7776 115.3418 55.1341 43.1801 174.0679 17 Q 4.2891 9.0298 119.5729 56.9259 30.0664 174.9041 18 E 4.8102 7.8267 115.9725 55.7507 33.1004 173.5556 19 A 5.5025 9.0663 120.2094 51.6169 23.2751 175.0753 20 A 5.0754 9.0095 119.3682 51.0330 23.4097 175.4142 21 I 4.7674 8.9912 121.8405 59.4912 40.0624 175.1381 22 V 4.4718 8.3888 126.3692 60.8824 34.6901 175.0006 23 G 3.9792 8.5752 115.6152 45.6225 0.0000 173.0346 24 Y 4.8800 8.5045 117.7755 56.9238 39.6468 175.0441 25 C 4.4175 8.1338 116.1021 60.5593 28.3757 175.2391 26 D 4.5574 9.3184 130.1930 55.9143 41.9961 176.1072 27 A 4.7575 7.5673 121.5728 50.3828 18.6773 175.9478 28 K 5.1689 7.8098 123.4200 52.9823 31.4598 175.1962 29 Y 4.7474 7.0893 122.2014 55.5390 41.4773 173.4861 30 V 4.0022 8.7007 120.3343 63.1523 31.4888 175.6735 31 W 4.7375 9.3434 128.8506 59.3481 29.8615 176.8627 32 A 4.9044 7.8417 118.9934 50.8566 22.0312 175.0920 33 A 5.2912 8.5027 122.0117 50.2183 22.6522 176.0806 34 T 4.1790 8.7969 110.8411 61.2674 69.6185 174.6395 35 A 4.1618 8.5678 127.1880 53.5752 19.0432 177.6972 36 G 3.8068 8.7473 108.9153 45.9113 0.0000 173.4865 37 G 4.0361 7.6071 108.2119 43.3165 0.0000 174.0106 38 V 3.8515 8.6363 111.6230 63.4545 32.0724 179.1813 39 F 4.4872 8.7674 119.5059 60.1821 38.8632 177.4526 40 Q 4.0920 8.1896 117.6458 58.6569 28.2401 177.0963 41 S 4.6285 8.0874 113.7713 58.0467 63.1513 173.8877 42 I 4.0511 7.6461 122.8037 61.7244 37.3991 176.2616 43 T 4.6394 8.4340 115.1162 59.4492 72.1917 173.9220 44 P 4.2586 0.0000 0.0000 65.9170 31.3469 178.7508 45 A 4.0230 7.9991 118.9107 55.2843 18.3801 179.3815 46 E 3.9671 8.2232 117.0822 59.5793 29.4341 179.6875 47 I 3.7857 8.0276 119.9605 64.5291 36.9595 178.0646 48 D 4.4191 8.2681 119.0284 57.4612 40.7672 178.9748 49 V 3.8250 7.7806 118.5171 66.0280 31.3809 177.9641 50 I 3.7799 7.5964 118.6550 63.9981 37.0979 177.4723 51 I 4.5791 7.7603 110.3941 59.8405 38.0858 175.9682 52 G 3.8900 7.2706 109.9392 45.3485 0.0000 174.3822 53 K 3.8404 8.3712 119.0667 58.6543 32.2774 177.1642 54 D 4.4628 7.8583 118.2118 53.7617 40.4438 175.8643 55 R 3.8320 8.1345 128.0560 55.7563 31.1612 177.2976 56 E 4.8893 8.2896 117.4693 56.3745 32.7678 178.6446 57 G 3.6555 8.1828 105.4950 47.5857 0.0000 175.2492 58 F 4.4651 7.5094 115.6646 59.0738 37.6015 177.2190 59 F 4.5023 8.2349 118.3038 60.5783 38.7538 177.1701 60 T 4.2704 8.0498 114.9044 65.7125 68.6900 175.9332 61 N 4.8134 8.2194 114.8177 52.3338 39.8161 176.2904 62 G 3.9849 8.2558 110.1810 44.8160 0.0000 172.2380 63 L 4.6933 8.2158 117.2827 54.6766 43.5217 174.6414 64 T 5.0689 8.1980 108.6413 59.8572 71.3648 173.8386 65 L 4.6204 8.3533 122.0802 54.0477 44.6239 176.9971 66 G 4.1097 10.1584 112.4663 46.2893 0.0000 174.1681 67 G 3.9180 8.5835 106.9838 44.7925 0.0000 174.5192 68 K 4.2085 7.8663 122.3027 55.4828 33.1533 175.9163 69 K 4.6014 8.5317 125.7053 56.8325 33.3650 175.7551 70 C 5.4043 9.2848 121.3803 58.1418 33.2941 172.8980 71 S 5.0877 9.2494 114.9416 56.6454 65.8461 173.1391 72 V 4.2028 8.1588 121.7413 62.1109 31.5728 175.3383 73 I 4.3887 8.8410 130.1630 63.6657 37.9690 176.3398 74 R 4.9664 7.6376 115.6666 55.3819 32.7848 173.7833 75 D 4.9785 8.9183 118.8865 53.0656 43.6231 175.2595 76 S 4.8510 8.8971 124.7035 58.1622 64.4768 176.4852 77 L 3.7565 8.6276 125.3416 57.5695 41.9395 177.6622 78 Y 4.3737 7.8195 113.6882 57.4302 38.4232 175.1532 79 V 4.1073 7.4823 121.3315 61.6576 31.6225 176.6975 80 D 4.3820 8.7765 128.5346 57.3212 40.8655 177.6033 81 S 4.5195 8.0235 110.8000 58.9599 62.8831 173.3764 82 D 4.6643 7.7173 119.3879 54.1118 43.9473 175.8640 83 C 4.4996 8.2883 113.7092 60.2881 26.0067 172.5849 84 T 5.7182 7.3950 105.9050 59.1967 72.5690 172.7817 85 M 5.1424 8.2522 120.0450 53.6888 36.8544 173.8634 86 D 5.4224 8.9758 121.2723 52.7250 43.9622 175.4334 87 I 5.0847 9.2393 123.4411 59.5123 41.9618 174.3850 88 R 5.1720 9.0542 124.0579 54.7149 33.3959 174.7620 89 T 4.5138 9.1246 116.9090 61.8692 69.7188 173.8603 90 K 4.7335 8.9651 123.1372 55.2294 33.9646 175.9077 91 S 4.8356 8.3657 116.3476 57.0620 66.2537 172.5261 92 Q 4.3533 8.2990 119.0482 57.1793 31.8164 174.5152 93 G 3.7886 7.9144 106.4846 46.0391 0.0000 173.8386 94 G 3.9232 8.9097 112.6540 44.8525 0.0000 173.2479 95 E 4.1159 7.9945 117.8362 54.8816 30.1707 174.9205 96 P 4.2100 0.0000 0.0000 62.9420 31.7792 175.6816 97 T 4.3010 7.6767 109.2200 60.0515 71.4279 173.0536 98 Y 4.9153 8.3509 119.1389 56.3471 42.2854 174.8029 99 N 5.1629 8.8646 119.8364 52.9999 40.7758 174.1868 100 V 5.0976 9.2831 121.1628 61.2174 35.2304 173.9219 101 A 5.1965 8.9991 128.9882 50.0816 22.1455 175.0500 102 V 4.3397 8.5308 121.1590 60.7593 34.6542 174.6070 103 G 4.3579 8.7151 114.3769 44.2375 0.0000 171.4354 104 R 4.6177 8.4418 123.9938 54.4567 31.5111 175.5087 105 A 4.5739 8.5140 132.0530 50.8815 21.2971 176.2752 106 G 3.8121 8.6936 104.2713 48.6013 0.0000 174.6966 107 R 4.0425 8.9656 112.9483 55.0349 32.0035 175.2649 108 V 4.6910 7.7486 112.5230 59.5814 36.1111 174.0631 109 L 4.8691 8.9494 122.8426 53.0468 44.4160 175.6305 110 V 4.6438 8.4419 123.2696 61.3184 33.6591 174.3479 111 F 5.0488 9.1035 126.5327 55.6906 41.9901 174.8653 112 V 5.2862 8.9124 115.4399 59.8527 36.1868 174.0521 113 M 5.2629 9.0392 123.6247 53.5316 34.6309 175.4710 114 G 4.1034 9.1385 114.0218 46.0748 0.0000 173.3259 115 K 4.4291 8.6504 121.5280 55.0672 34.0472 176.1592 116 E 4.2873 8.8006 122.1551 58.0542 29.7044 176.9431 117 G 3.8724 8.9142 113.1578 45.6999 0.0000 173.1245 118 V 3.8313 7.6675 120.2845 62.0489 32.2438 176.3948 119 H 4.6716 8.5547 124.4954 55.6238 30.6183 176.7179 120 G 3.8526 8.7397 109.7834 47.6638 0.0000 176.3406 121 G 3.7697 8.2107 107.7610 47.8692 0.0000 175.9140 122 G 3.6244 8.0317 108.0991 47.2308 0.0000 175.5069 123 L 4.0312 7.5717 120.2260 57.6558 41.5522 179.1297 124 N 4.2781 8.3647 117.0790 56.6543 38.8622 176.8102 125 K 3.9686 8.0799 120.9862 59.4145 32.1670 178.9158 126 K 3.9942 8.2128 118.6366 59.4641 31.9057 179.2226 127 A 3.9960 8.2695 121.1599 55.1321 18.2636 179.0379 128 Y 3.9445 8.4108 118.4542 60.8815 38.9010 178.3441 129 S 4.0388 8.4761 114.1054 61.6063 62.4692 175.8481 130 M 4.2446 8.4277 121.4978 58.4874 31.6781 178.4562 131 A 3.9777 8.2206 120.9891 55.1884 18.4449 179.8168 132 K 3.7563 7.8038 116.7682 59.6902 32.0591 178.8161 133 Y 4.1549 8.1217 119.7021 60.9606 38.6298 178.3697 134 L 3.8732 8.3683 120.0707 57.5239 41.6883 179.6340 135 R 3.8878 8.2791 118.5095 59.5532 29.8573 178.7874 136 D 4.3773 8.0160 117.1305 57.0594 40.8533 178.2203 137 S 4.4165 7.2743 112.7932 58.2575 63.2505 174.8670 138 G 3.7374 7.8278 110.1749 44.9362 0.0000 173.9897 139 F 4.4651 8.5423 124.6103 57.4304 39.2844 175.3139 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 -2 G 8.35 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 -1 S 7.84 4.63 0.00 3.93 3.61 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 0 M 8.99 4.40 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.57 0.00 1 A 8.13 4.21 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.00 3.52 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 0.00 0.00 0.00 3 W 8.47 4.38 0.00 3.62 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.40 4.12 0.00 2.39 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.70 0.00 5 S 8.13 4.15 0.00 4.08 3.96 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 6 Y 8.24 4.45 0.00 3.14 3.33 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 7 V 8.18 3.68 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 1.02 0.00 0.00 1.14 0.00 0.00 8 D 8.52 4.48 0.00 2.90 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 9 N 7.86 4.28 0.00 2.69 2.75 0.00 0.00 6.84 6.20 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 10 L 7.96 4.07 0.00 1.82 1.71 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 11 M 7.79 4.26 0.00 1.98 2.21 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 2.60 2.71 0.00 12 C 7.71 4.42 0.00 3.08 2.95 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 13 D 7.35 4.42 0.00 2.63 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 14 G 8.37 4.14 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 0.00 0.00 0.00 15 C 9.01 4.47 0.00 3.12 3.41 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 16 C 7.78 5.72 0.00 2.99 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 17 Q 9.03 4.29 0.00 1.82 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.28 1.99 0.00 18 E 7.83 4.81 0.00 1.94 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 1.86 1.55 0.00 19 A 9.07 5.50 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 20 A 9.01 5.08 1.16 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 21 I 8.99 4.77 1.77 0.00 0.00 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 1.37 1.45 -0.08 0.00 0.00 22 V 8.39 4.47 2.21 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 0.96 0.00 0.00 0.82 0.00 0.00 23 G 8.58 3.98 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 0.00 0.00 0.00 24 Y 8.50 4.88 0.00 2.90 2.89 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 25 C 8.13 4.42 0.00 2.73 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 0.00 0.00 0.00 26 D 9.32 4.56 0.00 2.67 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 27 A 7.57 4.76 1.21 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 0.00 0.00 28 K 7.81 5.17 0.00 2.00 1.83 0.00 1.71 0.00 0.00 2.49 0.00 0.00 3.10 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.34 7.81 29 Y 7.09 4.75 0.00 3.10 3.06 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 30 V 8.70 4.00 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 0.89 0.00 0.00 0.94 0.00 0.00 31 W 9.34 4.74 0.00 2.83 2.79 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 0.00 0.00 0.00 32 A 7.84 4.90 1.44 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 33 A 8.50 5.29 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 34 T 8.80 4.18 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 1.25 0.00 0.00 35 A 8.57 4.16 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 36 G 8.75 3.81 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 0.00 0.00 0.00 37 G 7.61 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 38 V 8.64 3.85 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 0.65 0.00 0.00 0.79 0.00 0.00 39 F 8.77 4.49 0.00 3.02 2.79 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 0.00 0.00 0.00 40 Q 8.19 4.09 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.11 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 41 S 8.09 4.63 0.00 4.07 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 42 I 7.65 4.05 1.78 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.45 0.75 0.00 0.00 43 T 8.43 4.64 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 1.26 0.00 0.00 44 P 0.00 4.26 0.00 2.23 2.23 0.00 3.64 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 2.18 2.44 0.00 45 A 8.00 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 3.97 0.00 2.19 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 2.41 2.36 0.00 47 I 8.03 3.79 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.81 1.00 0.00 0.00 48 D 8.27 4.42 0.00 2.87 2.79 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 0.00 0.00 0.00 49 V 7.78 3.82 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 1.22 0.00 0.00 1.03 0.00 0.00 50 I 7.60 3.78 2.10 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 1.79 1.11 0.81 0.00 0.00 51 I 7.76 4.58 2.05 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.71 0.75 0.00 0.00 52 G 7.27 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 0.00 0.00 0.00 53 K 8.37 3.84 0.00 1.70 1.80 0.00 1.68 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.32 7.81 54 D 7.86 4.46 0.00 2.52 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 55 R 8.13 3.83 0.00 1.82 2.18 0.00 3.44 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 56 E 8.29 4.89 0.00 1.94 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 2.23 2.39 0.00 57 G 8.18 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 0.00 0.00 0.00 58 F 7.51 4.47 0.00 2.93 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 59 F 8.23 4.50 0.00 3.32 3.19 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 60 T 8.05 4.27 4.42 0.00 0.00 0.00 0.00 0.00 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 61 N 8.22 4.81 0.00 2.74 2.89 0.00 0.00 6.86 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 62 G 8.26 3.98 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 0.00 0.00 0.00 63 L 8.22 4.69 0.00 1.86 1.76 0.91 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 64 T 8.20 5.07 4.15 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 1.23 0.00 0.00 65 L 8.35 4.62 0.00 1.78 1.63 1.12 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 66 G 10.16 4.11 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 0.00 67 G 8.58 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 68 K 7.87 4.21 0.00 1.85 1.89 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.48 7.81 69 K 8.53 4.60 0.00 1.77 1.73 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.49 7.81 70 C 9.28 5.40 0.00 2.94 2.85 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 0.00 0.00 0.00 71 S 9.25 5.09 0.00 3.84 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 72 V 8.16 4.20 1.49 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 0.24 0.00 0.00 0.17 0.00 0.00 73 I 8.84 4.39 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.98 0.95 0.00 0.00 74 R 7.64 4.97 0.00 1.93 2.05 0.00 3.02 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 75 D 8.92 4.98 0.00 2.68 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 76 S 8.90 4.85 0.00 3.97 3.79 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 0.00 0.00 0.00 77 L 8.63 3.76 0.00 1.78 1.32 0.62 0.49 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 78 Y 7.82 4.37 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 79 V 7.48 4.11 2.27 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 1.08 0.00 0.00 0.99 0.00 0.00 80 D 8.78 4.38 0.00 2.74 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 81 S 8.02 4.52 0.00 4.02 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 82 D 7.72 4.66 0.00 2.61 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 83 C 8.29 4.50 0.00 3.12 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 84 T 7.39 5.72 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 1.37 0.00 0.00 85 M 8.25 5.14 0.00 1.75 1.74 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 86 D 8.98 5.42 0.00 2.56 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 9.24 5.08 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.66 0.98 0.00 0.00 88 R 9.05 5.17 0.00 1.80 1.71 0.00 3.09 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 89 T 9.12 4.51 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 1.37 0.00 0.00 90 K 8.97 4.73 0.00 1.69 1.77 0.00 1.66 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.50 7.81 91 S 8.37 4.84 0.00 3.88 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 92 Q 8.30 4.35 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.23 2.55 0.00 93 G 7.91 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.91 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 95 E 7.99 4.12 0.00 2.07 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 0.00 2.28 2.18 0.00 96 P 0.00 4.21 0.00 1.66 1.97 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 97 T 7.68 4.30 4.29 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 1.16 0.00 0.00 98 Y 8.35 4.92 0.00 2.89 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 99 N 8.86 5.16 0.00 2.72 2.78 0.00 0.00 6.46 7.68 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 0.00 100 V 9.28 5.10 2.21 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 1.27 0.00 0.00 1.14 0.00 0.00 101 A 9.00 5.20 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 0.00 102 V 8.53 4.34 1.73 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 0.06 0.00 0.00 0.62 0.00 0.00 103 G 8.72 4.36 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 0.00 104 R 8.44 4.62 0.00 1.37 1.51 0.00 2.69 0.00 0.00 2.43 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.00 105 A 8.51 4.57 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.69 3.81 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 0.00 0.00 0.00 107 R 8.97 4.04 0.00 1.60 1.93 0.00 2.94 0.00 0.00 3.35 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 108 V 7.75 4.69 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 -0.80 0.00 0.00 0.74 0.00 0.00 109 L 8.95 4.87 0.00 1.54 1.02 0.86 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.44 4.64 1.98 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 1.10 0.00 0.00 0.97 0.00 0.00 111 F 9.10 5.05 0.00 2.31 1.71 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 0.00 112 V 8.91 5.29 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 0.84 0.00 0.00 0.99 0.00 0.00 113 M 9.04 5.26 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 114 G 9.14 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 0.00 0.00 0.00 115 K 8.65 4.43 0.00 1.76 1.78 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.74 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.51 7.81 116 E 8.80 4.29 0.00 2.15 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 0.00 2.32 2.33 0.00 117 G 8.91 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 0.00 0.00 0.00 118 V 7.67 3.83 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 0.81 0.00 0.00 1.08 0.00 0.00 119 H 8.55 4.67 0.00 3.21 3.19 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.74 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.21 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 0.00 0.00 0.00 122 G 8.03 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 0.00 123 L 7.57 4.03 0.00 1.97 1.78 1.02 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.36 4.28 0.00 2.97 2.99 0.00 0.00 6.86 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 0.00 125 K 8.08 3.97 0.00 1.91 1.95 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.58 7.81 126 K 8.21 3.99 0.00 2.03 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.65 7.81 127 A 8.27 4.00 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 0.00 128 Y 8.41 3.94 0.00 3.11 3.24 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 0.00 129 S 8.48 4.04 0.00 4.06 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 0.00 130 M 8.43 4.24 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.71 0.00 131 A 8.22 3.98 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 0.00 132 K 7.80 3.76 0.00 1.89 1.79 0.00 1.58 0.00 0.00 1.31 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.13 0.71 7.81 133 Y 8.12 4.15 0.00 3.10 3.25 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 0.00 134 L 8.37 3.87 0.00 1.89 1.83 1.10 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 135 R 8.28 3.89 0.00 2.05 1.94 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 136 D 8.02 4.38 0.00 2.73 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 0.00 137 S 7.27 4.42 0.00 3.93 3.85 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 0.00 0.00 0.00 138 G 7.83 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 0.00 0.00 0.00 139 F 8.54 4.47 0.00 3.36 2.90 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