NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4153 8.3001 120.3262 55.4900 33.3631 174.0351 2 A 4.5547 8.0535 122.6081 49.0176 22.4147 170.8022 3 V 4.2599 8.3846 119.9828 59.6914 34.5757 173.9973 4 A 4.3075 8.4787 127.7510 51.9843 19.3775 175.2045 5 D 4.7878 8.0549 116.5567 52.6581 44.0602 176.0522 6 L 3.9526 8.6119 123.8625 57.6633 41.9102 179.5651 7 A 3.8314 8.3354 121.1039 54.7270 18.4698 178.6931 8 L 4.1760 7.8723 115.5304 57.1812 42.0291 177.9888 9 I 3.7980 7.1044 119.8164 60.2810 37.3545 174.1290 10 P 4.1778 0.0000 0.0000 63.6165 31.9879 175.6797 11 D 4.5483 8.7696 122.4009 56.3889 42.5378 176.0847 12 V 4.8827 7.4808 116.2975 61.1105 34.7702 174.6128 13 D 4.7927 8.7289 126.3697 53.2076 44.6809 173.8853 14 I 3.9991 8.2194 118.0902 59.4388 40.2420 174.0663 15 D 4.6691 8.0995 122.5447 52.7472 43.3215 174.3610 16 S 3.9547 8.0973 121.4984 56.5541 65.3902 175.2246 17 D 4.7537 7.5592 125.4226 50.6072 42.3684 176.5786 18 G 4.5363 7.1703 114.9258 45.6280 0.0000 175.8298 19 V 4.5239 8.3263 125.3239 60.5464 33.5807 173.6853 20 F 4.8749 7.5065 119.8885 55.7740 41.3104 173.7425 21 K 4.7439 8.5913 119.6316 56.5378 33.7697 175.3541 22 Y 5.0232 8.8496 119.5172 55.8158 42.1476 174.1523 23 V 4.1315 8.4956 112.6487 59.2430 36.4634 174.2418 24 L 4.9958 7.7790 124.7128 53.6125 43.9747 175.1398 25 I 4.6608 8.3567 126.8083 59.2450 40.4762 175.0230 26 R 4.4484 8.7352 128.3751 56.1936 31.3970 175.3284 27 V 4.9260 8.7947 124.5644 61.5053 34.9966 173.8254 28 H 5.3205 8.8901 122.6631 53.8194 33.0628 173.4121 29 S 4.5791 9.0067 117.6811 58.7765 61.4354 173.6407 30 A 4.6934 8.1002 124.7345 50.8179 20.5203 174.0698 31 P 4.6093 0.0000 0.0000 65.6104 31.7846 176.4995 32 R 3.8396 9.0430 117.7658 56.3360 28.4985 176.4013 33 S 3.8706 8.0778 111.1121 59.0230 60.9340 173.4710 34 G 4.0197 7.9531 103.2130 45.8469 0.0000 174.3078 35 A 4.0734 8.0802 124.1412 51.8153 18.7195 176.5859 36 P 4.3338 0.0000 0.0000 64.7243 32.0186 176.9016 37 A 4.2244 7.7852 120.9831 52.5089 18.7938 176.3976 38 A 4.6893 7.9852 120.5451 51.7429 19.6571 176.5528 39 E 4.5073 8.0582 119.9345 57.6133 31.5766 176.0744 40 S 5.1531 8.2912 114.9124 57.4984 67.2932 173.3690 41 K 4.6528 8.9716 121.9149 55.5427 36.1195 174.2605 42 E 5.3051 8.6328 121.6553 54.3851 33.2237 175.3510 43 I 4.8544 8.7632 115.4966 59.1007 41.7896 174.2380 44 V 4.9287 8.3510 123.0480 61.4065 33.7555 174.5728 45 R 5.0418 7.9732 125.7883 53.1585 34.3695 174.8493 46 G 4.2892 7.0854 105.2731 46.1458 0.0000 171.7598 47 Y 4.5580 7.5869 119.4447 55.9793 42.1368 176.2217 48 K 4.0047 7.6418 124.2555 59.0212 32.5099 178.4717 49 W 4.3025 7.6331 114.8034 58.8485 28.1523 176.5460 50 A 4.3090 7.5069 123.6879 50.7741 16.1054 177.2081 51 E 3.8782 7.9510 121.3716 57.7510 30.7461 176.2818 52 Y 5.0015 6.7412 115.5090 55.0147 41.4331 175.9228 53 H 4.3294 9.0566 118.3238 58.8547 28.8533 177.7789 54 A 4.4399 8.6305 122.3280 55.2320 18.0953 179.1139 55 D 4.4078 8.2403 116.6190 57.5700 41.3540 178.5178 56 I 4.0554 7.8593 113.2536 64.2744 37.7649 177.3027 57 Y 4.2582 8.1337 121.5575 60.3648 38.5883 177.5604 58 D 4.2198 8.4488 119.0837 57.1479 41.3946 178.0621 59 K 3.8725 8.1282 120.0352 59.5668 32.2802 178.9873 60 V 3.6742 8.3737 118.7556 66.3540 31.5392 178.3034 61 S 4.5701 8.4933 114.7085 60.9406 62.4979 176.9799 62 G 3.5765 8.0952 109.0868 47.7919 0.0000 175.2546 63 D 4.3178 8.2076 121.0224 57.1511 41.1842 178.0283 64 M 4.0508 8.4771 119.5520 58.8506 31.8155 178.9539 65 Q 4.2482 8.3672 119.3563 58.1076 28.5834 178.8788 66 K 4.1062 8.0516 119.4270 59.4960 32.3372 179.0783 67 Q 4.1725 8.3328 118.6645 58.3541 28.3776 176.9414 68 G 3.5830 8.2278 110.4405 45.4657 0.0000 174.1907 69 C 4.1027 8.1898 118.0689 60.6242 29.3890 172.6075 70 D 4.9914 8.3591 121.5340 53.2753 43.1376 174.8389 71 C 5.4041 8.4733 120.1618 58.6535 33.0930 172.9604 72 E 4.8810 8.9114 120.9112 54.8094 32.9984 174.0127 73 C 4.0575 7.2444 122.7390 58.1783 29.4304 174.1126 74 L 3.9892 8.7829 123.6728 55.5565 42.2271 177.3371 75 G 3.7476 6.6495 104.7223 45.6210 0.0000 170.3676 76 G 4.0898 7.5633 106.0422 44.8085 0.0000 171.7481 77 G 4.6878 7.7099 103.8254 46.0443 0.0000 172.6364 78 R 5.0970 8.5482 115.6267 54.4753 33.6726 174.1583 79 I 4.8102 7.8223 120.9175 59.8174 39.7336 175.0501 80 S 5.3214 9.2693 121.1128 56.0891 67.8514 174.2639 81 H 4.8129 8.5944 114.9331 57.6627 29.0337 174.5205 82 Q 3.8319 8.9795 119.5268 56.8882 27.8718 179.6367 83 S 3.3578 8.8586 122.1866 60.7135 62.9638 172.9574 84 Q 4.5585 8.4950 125.3687 56.2140 29.8510 174.4124 85 D 4.5220 7.7434 117.1761 52.7204 43.4505 175.2209 86 K 4.0675 8.5651 125.1322 56.8077 32.3027 176.8802 87 K 3.9851 7.7155 121.1274 57.0840 32.4031 176.6216 88 I 4.1340 8.6463 128.4176 61.9091 38.6060 174.6275 89 H 5.4030 9.4599 124.3116 54.5727 33.9164 172.1837 90 V 5.0598 8.0081 123.1850 61.6437 35.0348 174.0638 91 Y 4.7509 8.6950 123.8552 57.7068 41.9580 173.2277 92 G 3.4426 10.6428 107.0696 45.4799 0.0000 171.7234 93 Y 4.9397 7.1472 114.3516 56.0102 40.7074 173.8947 94 S 4.5399 8.2878 115.3470 57.7490 63.6406 174.5365 95 M 4.1907 8.5532 121.5593 57.0953 31.9683 177.5423 96 A 3.8761 7.8109 121.0777 54.1632 18.6352 177.1811 97 Y 4.6654 7.5912 109.6646 56.4664 40.3263 176.3772 98 G 3.7927 8.0366 109.7292 43.4941 0.0000 170.9353 99 P 4.6865 0.0000 0.0000 62.3988 31.7660 176.2946 100 A 4.1492 7.8411 124.3409 51.6661 19.3473 179.1653 101 Q 4.0045 7.9202 119.0690 54.9546 26.5768 176.6223 102 H 4.0302 7.7345 122.5376 57.2354 28.8688 176.4218 103 A 3.6664 6.6127 122.4646 55.1657 18.1029 179.5570 104 I 3.5858 7.6318 118.0703 64.4695 37.0044 178.7430 105 S 4.0307 7.8636 115.7227 61.7723 62.6916 176.7928 106 T 3.8970 7.8286 112.2110 65.0082 68.5432 176.3180 107 E 4.0291 7.9563 121.6236 58.8037 29.3887 179.6411 108 K 3.9344 8.0799 118.4415 59.6080 32.1680 179.6009 109 I 3.7172 8.1360 120.5125 64.0838 36.7429 178.5699 110 K 3.9929 8.3679 118.7867 59.6400 32.0362 178.8979 111 A 4.1183 7.7590 119.5058 54.9879 18.3142 179.3054 112 K 3.9062 8.0785 117.6185 58.3035 33.8502 176.8167 113 Y 4.9272 7.9158 116.0983 55.5828 37.9185 174.3157 114 P 4.5444 0.0000 0.0000 64.7750 32.2670 178.2641 115 D 4.4947 8.2745 117.9446 56.3509 41.4068 174.3372 116 Y 4.9581 7.9362 115.6034 56.0602 41.0794 173.5575 117 E 4.9481 8.3534 119.2808 55.1310 33.7713 174.4329 118 V 5.1613 8.3138 121.5818 61.5926 35.2480 173.8678 119 T 5.0856 9.0644 115.9199 59.9929 72.8308 172.1674 120 W 5.6759 8.6210 116.8157 54.5668 31.6802 174.5580 121 A 4.2103 8.3673 121.8689 51.1891 21.5629 176.4166 122 N 4.9543 9.1919 120.7012 54.5034 39.4753 175.2069 123 D 4.4952 7.8416 116.1695 57.7580 41.5167 176.5325 124 G 4.2543 7.9138 106.6244 44.7274 0.0000 172.7155 125 Y 4.0028 8.6029 119.6320 57.6899 39.1714 175.3495 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 M 8.30 4.42 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 2 A 8.05 4.55 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 3 V 8.38 4.26 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 0.73 0.00 0.00 0.93 0.00 0.00 4 A 8.48 4.31 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 5 D 8.05 4.79 0.00 2.71 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.61 3.95 0.00 1.74 1.70 1.01 0.86 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 7 A 8.34 3.83 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 8 L 7.87 4.18 0.00 1.77 1.74 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.10 3.80 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 1.31 0.68 0.92 0.00 0.00 10 P 0.00 4.18 0.00 2.06 2.03 0.00 3.69 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 2.07 2.11 0.00 11 D 8.77 4.55 0.00 2.77 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 12 V 7.48 4.88 1.96 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 0.74 0.00 0.00 0.90 0.00 0.00 13 D 8.73 4.79 0.00 2.84 2.53 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 14 I 8.22 4.00 1.76 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.83 0.00 0.00 15 D 8.10 4.67 0.00 2.87 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 16 S 8.10 3.95 0.00 3.73 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 17 D 7.56 4.75 0.00 2.53 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 18 G 7.17 4.54 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 0.00 0.00 0.00 19 V 8.33 4.52 2.14 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 0.86 0.00 0.00 1.01 0.00 0.00 20 F 7.51 4.87 0.00 3.10 3.10 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 21 K 8.59 4.74 0.00 1.82 1.51 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.33 7.81 22 Y 8.85 5.02 0.00 3.04 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 23 V 8.50 4.13 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 0.62 0.00 0.00 0.83 0.00 0.00 24 L 7.78 5.00 0.00 1.66 1.36 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.36 4.66 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.50 0.86 0.00 0.00 26 R 8.74 4.45 0.00 1.80 1.78 0.00 3.02 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.60 0.00 27 V 8.79 4.93 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 0.95 0.00 0.00 0.91 0.00 0.00 28 H 8.89 5.32 0.00 3.09 3.11 0.00 5.67 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 29 S 9.01 4.58 0.00 3.80 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 30 A 8.10 4.69 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 31 P 0.00 4.61 0.00 2.19 2.02 0.00 3.76 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 2.21 2.15 0.00 32 R 9.04 3.84 0.00 1.95 1.99 0.00 3.48 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 33 S 8.08 3.87 0.00 4.00 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 34 G 7.95 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.08 4.07 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 36 P 0.00 4.33 0.00 2.19 2.19 0.00 3.78 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 1.98 1.96 0.00 37 A 7.79 4.22 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 38 A 7.99 4.69 1.22 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 0.00 0.00 0.00 39 E 8.06 4.51 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 2.33 2.44 0.00 40 S 8.29 5.15 0.00 3.69 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.97 4.65 0.00 1.72 1.56 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.55 7.81 42 E 8.63 5.31 0.00 1.77 1.74 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 2.13 2.26 0.00 43 I 8.76 4.85 1.88 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 1.22 0.95 0.94 0.00 0.00 44 V 8.35 4.93 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 0.88 0.00 0.00 0.92 0.00 0.00 45 R 7.97 5.04 0.00 1.79 1.87 0.00 3.60 0.00 0.00 3.56 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 46 G 7.09 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 0.00 0.00 0.00 0.00 47 Y 7.59 4.56 0.00 1.43 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 48 K 7.64 4.00 0.00 1.74 1.78 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.44 7.81 49 W 7.63 4.30 0.00 3.39 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 50 A 7.51 4.31 1.33 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 0.00 0.00 51 E 7.95 3.88 0.00 1.92 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 0.00 2.44 2.51 0.00 52 Y 6.74 5.00 0.00 3.01 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 53 H 9.06 4.33 0.00 3.51 3.47 0.00 5.83 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 54 A 8.63 4.44 1.64 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 55 D 8.24 4.41 0.00 2.39 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 56 I 7.86 4.06 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.06 1.09 0.00 0.00 57 Y 8.13 4.26 0.00 2.85 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 58 D 8.45 4.22 0.00 2.88 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 59 K 8.13 3.87 0.00 1.93 2.16 0.00 1.33 0.00 0.00 1.01 0.00 0.00 2.56 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.52 1.40 7.81 60 V 8.37 3.67 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 1.00 0.00 0.00 1.20 0.00 0.00 61 S 8.49 4.57 0.00 4.13 3.99 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 62 G 8.10 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.21 4.32 0.00 2.83 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 64 M 8.48 4.05 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.94 0.00 65 Q 8.37 4.25 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 66 K 8.05 4.11 0.00 1.87 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.61 7.81 67 Q 8.33 4.17 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 68 G 8.23 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.19 4.10 0.00 3.04 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 70 D 8.36 4.99 0.00 2.81 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 71 C 8.47 5.40 0.00 2.95 2.82 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 72 E 8.91 4.88 0.00 2.08 1.74 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 2.16 2.30 0.00 73 C 7.24 4.06 0.00 2.27 1.18 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 0.00 0.00 0.00 0.00 74 L 8.78 3.99 0.00 1.39 1.65 0.84 0.92 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 75 G 6.65 3.75 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 76 G 7.56 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 0.00 0.00 0.00 77 G 7.71 4.69 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 0.00 0.00 0.00 78 R 8.55 5.10 0.00 1.60 1.75 0.00 2.53 0.00 0.00 2.88 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 79 I 7.82 4.81 1.04 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.73 0.83 0.00 0.00 80 S 9.27 5.32 0.00 3.90 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 81 H 8.59 4.81 0.00 3.15 3.34 0.00 5.54 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.98 3.83 0.00 2.08 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.96 5.96 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 83 S 8.86 3.36 0.00 4.05 3.68 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 84 Q 8.50 4.56 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 85 D 7.74 4.52 0.00 2.51 2.42 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 0.00 86 K 8.57 4.07 0.00 1.44 1.55 0.00 1.59 0.00 0.00 1.49 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.30 1.37 7.81 87 K 7.72 3.99 0.00 1.91 1.75 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.49 7.81 88 I 8.65 4.13 1.97 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 1.27 0.67 0.95 0.00 0.00 89 H 9.46 5.40 0.00 3.14 3.04 0.00 5.72 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 90 V 8.01 5.06 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 0.56 0.00 0.00 0.84 0.00 0.00 91 Y 8.70 4.75 0.00 3.20 3.02 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 0.00 0.00 0.00 92 G 10.64 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 93 Y 7.15 4.94 0.00 2.76 2.82 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 94 S 8.29 4.54 0.00 3.65 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 95 M 8.55 4.19 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.57 0.00 96 A 7.81 3.88 0.49 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 97 Y 7.59 4.67 0.00 2.92 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 98 G 8.04 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 99 P 0.00 4.69 0.00 2.24 2.21 0.00 3.66 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 100 A 7.84 4.15 1.09 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 0.00 0.00 101 Q 7.92 4.00 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 102 H 7.73 4.03 0.00 2.42 3.15 0.00 6.11 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 0.00 103 A 6.61 3.67 1.14 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 0.00 104 I 7.63 3.59 1.86 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 1.45 0.64 0.86 0.00 0.00 105 S 7.86 4.03 0.00 3.73 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 0.00 106 T 7.83 3.90 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 1.40 0.00 0.00 107 E 7.96 4.03 0.00 1.95 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 0.00 2.52 2.52 0.00 108 K 8.08 3.93 0.00 1.96 1.80 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.56 7.81 109 I 8.14 3.72 1.88 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.68 1.06 0.00 0.00 110 K 8.37 3.99 0.00 1.88 1.92 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.66 7.81 111 A 7.76 4.12 1.33 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 0.00 0.00 112 K 8.08 3.91 0.00 1.65 1.61 0.00 1.41 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.91 0.65 7.81 113 Y 7.92 4.93 0.00 3.11 2.62 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 0.00 114 P 0.00 4.54 0.00 2.22 2.21 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 115 D 8.27 4.49 0.00 2.73 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 7.94 4.96 0.00 3.02 2.87 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 0.00 117 E 8.35 4.95 0.00 2.02 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 0.00 2.29 2.32 0.00 118 V 8.31 5.16 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 0.90 0.00 0.00 1.02 0.00 0.00 119 T 9.06 5.09 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 0.00 120 W 8.62 5.68 0.00 3.52 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 0.00 121 A 8.37 4.21 1.19 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 0.00 0.00 122 N 9.19 4.95 0.00 3.17 3.08 0.00 0.00 7.42 8.85 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 0.00 123 D 7.84 4.50 0.00 2.74 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 0.00 124 G 7.91 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 0.00 0.00 0.00 0.00 125 Y 8.60 4.00 0.00 2.81 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