NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3256 8.3149 120.1403 55.2915 34.1819 175.7357 7 L 3.9579 7.9996 119.6711 54.8676 42.0154 174.4539 8 H 5.1021 9.4038 123.0359 54.3147 34.0215 172.2329 9 K 4.6259 8.5764 123.0717 55.5927 33.4087 175.9056 10 E 4.9440 9.2964 123.2521 53.6019 33.3743 173.9151 11 P 5.0143 0.0000 0.0000 63.3266 32.3475 174.9799 12 A 4.9360 8.4733 121.5609 51.3338 23.0042 175.5412 13 T 4.6462 8.5820 115.3754 61.2672 71.8379 173.9422 14 L 4.2513 8.6667 127.8930 55.8760 42.4603 175.5711 15 I 4.3871 8.5789 125.9015 62.2656 39.0714 176.0344 16 K 4.5332 7.5780 120.4396 55.2797 35.5191 174.1469 17 A 4.5284 8.7383 130.6005 52.1100 19.2889 176.9189 18 I 4.2153 8.0818 122.5648 62.6556 38.5499 174.9473 19 D 4.4958 7.4757 117.3069 53.2774 43.8390 175.7582 20 G 3.7206 8.8828 109.3960 47.8731 0.0000 174.0097 21 D 4.9074 8.0626 116.4887 52.9864 40.4197 175.2049 22 T 5.1900 7.8220 116.3184 62.3951 72.8818 173.3073 23 V 4.8327 8.9257 118.6354 59.4293 36.3793 174.2835 24 K 4.9687 9.1804 126.1481 55.2512 33.6747 175.2778 25 L 5.3090 9.3159 126.9457 53.0818 46.5099 175.2178 26 M 4.8915 9.2288 122.1806 55.0429 33.5654 174.2711 27 Y 5.0647 9.0553 127.9190 56.1235 42.1261 175.5410 28 K 3.6162 9.3596 126.4297 57.4887 29.7724 175.9889 29 G 3.9268 8.3641 103.1006 45.9665 0.0000 173.5857 30 Q 4.7807 7.8748 119.1428 53.0618 31.3732 173.6062 31 P 4.9559 0.0000 0.0000 63.1578 32.3685 175.4476 32 M 4.8497 9.3382 122.4037 54.6062 36.4528 173.4577 33 T 4.8806 8.4863 121.5173 62.8153 70.6006 173.4971 34 F 5.1028 9.6773 125.0123 55.6190 42.2621 174.1887 35 R 4.9327 8.8396 124.0290 54.6227 31.8679 175.2161 36 L 4.5080 8.6772 127.5356 54.4171 41.9513 177.1465 37 L 3.9225 8.5492 125.1424 55.9068 42.7655 178.2400 38 L 4.0349 9.0652 121.1621 54.8526 39.1486 173.9629 39 V 4.9786 7.2456 110.5789 59.6002 35.6993 174.8320 40 D 5.0190 9.0079 123.7435 52.9678 42.9189 175.7431 41 T 4.7875 8.3668 113.7874 59.1389 71.2794 173.0162 42 P 4.4955 0.0000 0.0000 62.7710 32.2924 175.6264 43 E 4.8445 10.2649 121.5461 54.9357 32.0834 177.1628 44 T 4.3436 8.4826 110.3212 62.5889 70.1833 175.6379 45 K 4.5754 7.4847 120.7084 55.5079 32.2672 176.1954 46 H 4.3337 8.6923 120.3796 55.1050 30.8461 173.6999 47 P 4.2220 0.0000 0.0000 65.1286 31.3936 177.0777 48 K 4.4056 8.2572 114.8464 56.9697 33.8413 176.9226 49 K 4.2262 8.1681 117.3549 55.7783 34.4135 177.5601 50 G 3.8014 8.1868 108.9794 46.7864 0.0000 176.2916 51 V 4.6100 8.4910 129.8261 61.1077 31.5778 173.7229 52 E 4.3254 9.1749 128.6789 55.0351 31.4297 176.0760 53 K 4.0110 8.2519 122.5748 58.2842 32.4868 176.5235 54 Y 4.5157 8.2297 124.0677 59.4466 35.8840 171.2191 55 G 3.6010 8.1229 107.6146 47.3923 0.0000 174.1974 56 P 4.3071 0.0000 0.0000 65.0397 31.3744 178.6536 57 E 4.0021 8.1706 116.7030 59.4384 29.5658 179.0392 58 A 4.0360 8.6024 121.1848 55.2088 18.4261 179.6663 59 S 4.1415 8.5868 111.9008 61.5157 62.4916 176.2887 60 A 4.0628 8.4786 123.9480 54.8313 18.0527 179.4612 61 F 3.9392 8.4413 119.2927 61.7902 39.5358 177.4060 62 T 3.8947 8.1525 115.3706 66.5022 68.2840 176.2616 63 K 3.8576 8.0542 121.3043 59.6972 32.2531 178.8708 64 K 3.9431 8.0601 118.5485 59.6274 31.7023 179.0900 65 M 3.8553 7.5471 117.5176 58.6560 32.1399 178.3645 66 V 3.8154 7.9095 112.4335 63.9815 31.5984 178.4535 67 E 3.9690 8.5596 118.0717 58.8651 29.4325 177.3750 68 N 4.6309 7.8872 113.5270 52.9691 39.0172 175.1243 69 A 4.5221 7.3100 121.6860 51.5944 19.4072 178.2187 70 K 4.1856 8.8383 120.6487 58.4854 32.6366 178.2376 71 K 4.6746 8.7340 118.0042 54.5353 36.0006 175.5956 72 I 5.0118 8.4035 124.9491 59.6688 39.9177 174.4478 73 E 5.1584 9.0952 124.7148 54.6756 33.9244 175.0783 74 V 4.7449 9.0587 115.4160 59.5131 35.4530 174.6469 75 E 4.9890 8.8520 123.9094 54.4578 32.2328 175.0790 76 F 4.6776 8.8968 125.7716 57.5884 40.1812 175.4321 77 D 4.9394 8.5752 120.9249 53.1758 43.0382 175.8255 78 K 4.3759 8.9062 117.8889 57.7109 33.8803 178.0886 79 G 4.1554 8.3250 111.8397 44.6992 0.0000 173.8874 80 Q 3.9464 8.7642 122.3990 57.0209 29.1933 176.9083 81 R 4.5585 8.5289 119.9185 56.1292 30.9465 175.8174 82 S 5.0484 7.5631 111.5353 56.6786 66.3520 173.1641 83 D 4.8864 8.3918 121.6844 51.5312 41.5208 176.9474 84 K 3.9311 8.3788 116.9001 59.4388 32.6296 176.9627 85 Y 4.3014 8.1093 115.9280 57.7054 38.0674 176.2492 86 G 3.9266 8.1917 108.3981 45.2896 0.0000 173.8964 87 R 4.3016 8.3718 119.9466 55.1081 31.4692 176.5297 88 G 3.5257 8.3295 111.0764 46.4421 0.0000 172.3289 89 L 5.2494 8.7997 123.7404 53.1504 43.2416 175.6495 90 A 4.4353 8.3933 124.4398 50.9892 23.5879 174.1216 91 Y 4.7995 8.5114 117.3936 57.3235 39.6689 175.0733 92 I 4.8249 8.6971 124.5719 59.6527 40.3609 174.0676 93 Y 5.0456 9.1183 124.1466 56.0502 41.0269 174.5599 94 A 4.8828 9.1073 125.9903 50.0979 21.2309 176.3992 95 D 4.2739 9.8637 125.5027 56.0133 39.0186 175.5092 96 G 3.9991 8.3929 105.3425 45.2344 0.0000 173.3182 97 K 4.5544 7.9879 120.4335 54.6931 33.8578 175.3691 98 M 3.9711 8.4986 123.5326 55.0641 33.3093 177.0975 99 V 3.6396 8.8663 127.0387 66.0535 31.6489 177.6944 100 N 4.3206 8.0582 115.8487 56.4309 38.4086 176.8177 101 E 3.8758 8.0623 119.7892 59.0648 29.9397 178.2521 102 A 4.0324 8.0965 120.8643 55.3069 18.3735 179.4676 103 L 3.5099 8.0049 117.2703 57.9278 41.7174 180.1008 104 V 3.7125 7.4872 118.1286 66.0524 31.3025 178.0431 105 R 3.9240 8.4093 117.5778 58.9716 29.9437 177.2504 106 Q 4.2578 7.6429 116.3670 55.2051 29.4019 175.3512 107 G 3.8672 8.1079 107.1250 47.8368 0.0000 174.6056 108 L 4.7311 7.8595 116.3779 53.7011 42.8017 176.3552 109 A 4.7128 7.6374 118.8458 50.8656 22.1369 176.2604 110 K 4.8479 8.6528 119.4279 54.5179 35.2482 176.1250 111 V 4.2110 9.2210 123.1508 62.8640 31.9954 176.0042 112 A 5.1980 8.7706 130.2126 50.8095 19.6863 176.3692 113 Y 3.8586 8.4873 120.5050 57.7261 39.1799 175.2849 114 V 3.8385 7.1196 126.7279 61.4756 33.1428 174.5341 115 Y 4.6759 8.0324 123.5267 55.9269 39.3490 175.5161 116 K 4.5758 8.5730 124.9268 55.8938 32.8329 175.0704 117 P 4.7864 0.0000 0.0000 63.1376 31.8128 177.0139 118 N 4.9078 7.9581 118.5609 52.5493 36.9046 175.0545 119 N 5.1141 7.7840 113.3466 53.1264 39.1799 177.5706 120 T 3.7918 8.6376 117.3762 67.8774 68.6783 175.1067 121 H 4.8157 7.8157 116.9961 55.9414 28.9678 176.9694 122 E 3.9517 8.3754 123.1201 59.6165 29.3137 178.8970 123 Q 3.9579 8.0306 117.3671 59.2836 28.8714 177.9507 124 H 4.1673 8.3060 118.6411 59.5728 29.7152 177.0434 125 L 3.9299 8.0137 120.5276 57.7966 41.4441 179.6820 126 R 3.9130 8.3587 118.4228 58.9657 30.0078 179.2132 127 K 3.9021 8.4387 118.7907 59.7626 32.0604 179.6054 128 S 4.1316 7.9900 115.2786 61.4430 62.6729 176.4156 129 E 3.9395 8.4969 122.3635 58.9896 29.3194 178.6958 130 A 3.7628 7.9197 121.0911 54.8928 18.3089 179.4177 131 Q 3.7781 7.8750 117.3400 59.3739 29.2326 178.3753 132 A 3.9781 8.1118 121.7777 54.9677 18.3159 179.8373 133 K 3.3108 7.5688 117.2651 59.1376 31.7754 179.4614 134 K 3.8875 7.7547 119.0005 59.2394 32.2243 177.8930 135 E 4.2020 8.2802 116.0476 55.4418 30.6509 176.2786 136 K 4.0398 7.8625 118.6762 57.2453 30.5954 174.8920 137 L 4.4317 8.0973 118.0069 55.1481 44.6898 177.7183 138 N 3.9577 9.2647 120.4025 54.0619 37.6495 176.7640 139 I 3.0190 5.4200 127.9196 64.4288 37.4981 176.6069 140 W 4.8584 7.8611 118.3337 56.4027 29.1390 176.4493 141 S 4.7764 8.0728 119.3724 57.8529 62.6784 173.9421 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 6 K 8.31 4.33 0.00 1.78 1.96 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.55 7.81 7 L 8.00 3.96 0.00 1.78 1.74 1.05 0.80 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 8 H 9.40 5.10 0.00 3.12 3.19 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.58 4.63 0.00 1.56 1.58 0.00 1.47 0.00 0.00 1.25 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 1.23 7.81 10 E 9.30 4.94 0.00 2.06 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 2.18 0.00 11 P 0.00 5.01 0.00 2.09 2.07 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 12 A 8.47 4.94 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 13 T 8.58 4.65 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 1.23 0.00 0.00 14 L 8.67 4.25 0.00 1.63 1.57 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.58 4.39 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 0.94 0.00 0.00 16 K 7.58 4.53 0.00 1.81 1.62 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.44 7.81 17 A 8.74 4.53 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 18 I 8.08 4.22 2.01 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 1.19 0.69 0.91 0.00 0.00 19 D 7.48 4.50 0.00 2.62 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.88 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 21 D 8.06 4.91 0.00 2.89 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.82 5.19 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 1.27 0.00 0.00 23 V 8.93 4.83 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 0.75 0.00 0.00 0.94 0.00 0.00 24 K 9.18 4.97 0.00 1.88 1.83 0.00 1.50 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.52 7.81 25 L 9.32 5.31 0.00 1.68 1.60 0.31 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.23 4.89 0.00 2.14 2.00 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 2.62 2.56 0.00 27 Y 9.06 5.06 0.00 3.26 3.04 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 28 K 9.36 3.62 0.00 1.35 1.64 0.00 1.34 0.00 0.00 1.32 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.10 0.79 7.81 29 G 8.36 3.93 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 0.00 0.00 0.00 30 Q 7.87 4.78 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.93 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 31 P 0.00 4.96 0.00 1.98 2.03 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 32 M 9.34 4.85 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.02 0.00 33 T 8.49 4.88 4.22 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 0.00 0.00 0.00 1.23 0.00 0.00 34 F 9.68 5.10 0.00 2.99 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 35 R 8.84 4.93 0.00 1.93 1.80 0.00 3.35 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 36 L 8.68 4.51 0.00 1.57 1.60 0.94 1.32 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 L 8.55 3.92 0.00 1.03 1.22 0.47 0.32 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 38 L 9.07 4.03 0.00 2.03 1.93 1.18 0.98 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 39 V 7.25 4.98 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 0.72 0.00 0.00 0.95 0.00 0.00 40 D 9.01 5.02 0.00 2.58 2.57 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 0.00 0.00 0.00 0.00 41 T 8.37 4.79 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 1.24 0.00 0.00 42 P 0.00 4.50 0.00 2.33 2.08 0.00 3.55 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.07 0.00 43 E 10.26 4.84 0.00 1.95 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 2.22 2.40 0.00 44 T 8.48 4.34 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 1.25 0.00 0.00 45 K 7.48 4.58 0.00 1.73 1.77 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.32 7.81 46 H 8.69 4.33 0.00 3.18 3.37 0.00 5.81 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.22 0.00 2.04 2.08 0.00 3.33 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 1.91 2.02 0.00 48 K 8.26 4.41 0.00 1.80 1.85 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.40 7.81 49 K 8.17 4.23 0.00 1.47 1.47 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.65 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.27 1.34 7.81 50 G 8.19 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.49 4.61 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 0.81 0.00 0.00 0.98 0.00 0.00 52 E 9.17 4.33 0.00 1.92 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 0.00 2.25 2.42 0.00 53 K 8.25 4.01 0.00 1.65 1.70 0.00 1.34 0.00 0.00 1.51 0.00 0.00 2.76 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.29 1.05 7.81 54 Y 8.23 4.52 0.00 3.16 3.13 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 55 G 8.12 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 56 P 0.00 4.31 0.00 2.17 2.11 0.00 3.58 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.17 4.00 0.00 2.38 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 2.52 2.50 0.00 58 A 8.60 4.04 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 59 S 8.59 4.14 0.00 3.94 4.07 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 60 A 8.48 4.06 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 61 F 8.44 3.94 0.00 3.21 3.21 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 62 T 8.15 3.89 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 1.27 0.00 0.00 63 K 8.05 3.86 0.00 1.98 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.57 7.81 64 K 8.06 3.94 0.00 1.67 1.73 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 65 M 7.55 3.86 0.00 1.85 1.71 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 66 V 7.91 3.82 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 0.80 0.00 0.00 1.02 0.00 0.00 67 E 8.56 3.97 0.00 1.96 1.99 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 2.33 2.41 0.00 68 N 7.89 4.63 0.00 2.89 2.80 0.00 0.00 6.99 7.38 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 69 A 7.31 4.52 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 70 K 8.84 4.19 0.00 1.83 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.53 7.81 71 K 8.73 4.67 0.00 1.65 1.65 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.40 5.01 2.00 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 1.32 0.97 0.89 0.00 0.00 73 E 9.10 5.16 0.00 1.89 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 74 V 9.06 4.74 1.41 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 0.03 0.00 0.00 0.57 0.00 0.00 75 E 8.85 4.99 0.00 2.18 2.16 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 2.50 2.41 0.00 76 F 8.90 4.68 0.00 3.06 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 77 D 8.58 4.94 0.00 2.71 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 78 K 8.91 4.38 0.00 1.91 1.96 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.46 7.81 79 G 8.32 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 80 Q 8.76 3.95 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 81 R 8.53 4.56 0.00 1.59 1.44 0.00 2.60 0.00 0.00 2.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 82 S 7.56 5.05 0.00 3.91 3.70 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 83 D 8.39 4.89 0.00 2.94 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 84 K 8.38 3.93 0.00 1.58 1.78 0.00 1.17 0.00 0.00 1.48 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.09 0.26 7.81 85 Y 8.11 4.30 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.19 3.93 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 0.00 0.00 0.00 87 R 8.37 4.30 0.00 2.11 1.82 0.00 3.13 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 88 G 8.33 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.80 5.25 0.00 1.55 1.62 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.39 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.51 4.80 0.00 3.01 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 92 I 8.70 4.82 1.77 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.08 0.81 0.00 0.00 93 Y 9.12 5.05 0.00 2.88 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 94 A 9.11 4.88 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 95 D 9.86 4.27 0.00 2.77 2.71 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 96 G 8.39 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 0.00 0.00 0.00 97 K 7.99 4.55 0.00 1.93 1.76 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.52 7.81 98 M 8.50 3.97 0.00 1.90 1.60 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.36 0.00 99 V 8.87 3.64 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 1.03 0.00 0.00 0.91 0.00 0.00 100 N 8.06 4.32 0.00 2.89 2.92 0.00 0.00 6.78 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 0.00 101 E 8.06 3.88 0.00 1.93 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 2.23 2.11 0.00 102 A 8.10 4.03 1.61 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 0.00 0.00 103 L 8.00 3.51 0.00 1.83 1.63 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.49 3.71 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 1.05 0.00 0.00 1.00 0.00 0.00 105 R 8.41 3.92 0.00 2.01 2.07 0.00 3.34 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 106 Q 7.64 4.26 0.00 1.96 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.30 0.00 0.00 0.00 0.00 0.00 1.88 2.19 0.00 107 G 8.11 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 0.00 108 L 7.86 4.73 0.00 1.30 1.48 0.52 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.64 4.71 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 0.00 110 K 8.65 4.85 0.00 1.76 1.98 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.13 1.23 7.81 111 V 9.22 4.21 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 0.76 0.00 0.00 0.96 0.00 0.00 112 A 8.77 5.20 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 0.00 113 Y 8.49 3.86 0.00 2.86 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 0.00 114 V 7.12 3.84 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 0.79 0.00 0.00 0.85 0.00 0.00 115 Y 8.03 4.68 0.00 3.07 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 0.00 116 K 8.57 4.58 0.00 1.77 1.76 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.40 7.81 117 P 0.00 4.79 0.00 2.21 2.15 0.00 3.80 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 1.97 2.00 0.00 118 N 7.96 4.91 0.00 2.99 2.88 0.00 0.00 6.62 7.42 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 0.00 119 N 7.78 5.11 0.00 2.96 2.94 0.00 0.00 6.10 7.22 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 0.00 120 T 8.64 3.79 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 1.11 0.00 0.00 121 H 7.82 4.82 0.00 2.89 3.14 0.00 5.63 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.38 3.95 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 2.30 2.34 0.00 123 Q 8.03 3.96 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.63 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 124 H 8.31 4.17 0.00 3.20 3.47 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.01 3.93 0.00 1.91 1.70 1.02 0.84 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 0.00 126 R 8.36 3.91 0.00 2.04 1.95 0.00 3.11 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 127 K 8.44 3.90 0.00 2.07 1.85 0.00 1.53 0.00 0.00 1.95 0.00 0.00 3.02 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.47 1.52 7.81 128 S 7.99 4.13 0.00 3.92 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 0.00 129 E 8.50 3.94 0.00 2.05 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 0.00 2.17 2.60 0.00 130 A 7.92 3.76 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 0.00 131 Q 7.87 3.78 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 132 A 8.11 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.57 3.31 0.00 1.48 1.19 0.00 0.77 0.00 0.00 0.61 0.00 0.00 2.65 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.76 7.81 134 K 7.75 3.89 0.00 1.70 1.98 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.43 7.81 135 E 8.28 4.20 0.00 1.96 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 2.47 0.00 136 K 7.86 4.04 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.39 7.81 137 L 8.10 4.43 0.00 1.79 1.69 1.02 0.62 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 0.00 138 N 9.26 3.96 0.00 2.70 1.59 0.00 0.00 7.13 7.21 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 0.00 139 I 5.42 3.02 1.09 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.09 -0.42 0.00 0.00 140 W 7.86 4.86 0.00 3.34 3.09 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 0.00 141 S 8.07 4.78 0.00 4.01 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