NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5394 8.3649 120.1958 53.5918 43.2113 175.1164 2 I 4.0345 7.7142 120.1103 59.2691 38.0732 173.0181 3 Q 4.5290 9.7932 129.2341 55.2215 31.5925 173.7032 4 M 5.1551 8.6788 125.3050 53.8769 34.7545 175.1004 5 T 4.5994 8.8742 120.5288 61.9492 70.9320 173.0568 6 Q 5.8240 8.7038 127.3231 53.8959 31.9157 174.4592 7 S 4.7241 8.3885 117.5086 56.7749 66.2639 172.2748 8 P 5.1320 0.0000 0.0000 61.7839 33.1646 175.8259 9 S 4.7445 8.5441 113.8345 61.5958 63.8578 174.7591 10 S 5.3020 7.8770 111.1774 57.5208 65.4906 174.1942 11 L 4.7373 8.7364 120.4631 54.7868 44.0329 174.3373 12 S 5.3062 8.6964 116.1084 57.0861 65.7298 173.0844 13 A 4.8001 8.7368 125.2797 50.7947 23.0288 174.4777 14 S 4.7858 8.9120 111.9716 56.6116 66.1555 175.0679 15 V 4.0261 8.1819 115.3391 63.0510 31.5667 175.8440 16 G 4.5461 9.2177 112.1652 45.2743 0.0000 173.6408 17 D 4.4703 7.9497 118.7107 54.2966 42.1613 175.6275 18 R 5.0162 8.2509 120.3605 54.6077 31.7366 175.5373 19 V 4.4610 8.7754 125.0310 61.3327 34.6348 174.1611 20 T 5.0133 8.5629 123.4932 61.8453 71.4073 173.3913 21 I 5.0268 8.8099 126.1883 59.7175 41.6597 174.5155 22 T 5.5066 9.1286 114.8063 60.3585 72.5979 172.0495 23 C 5.6701 10.0625 119.6747 55.4344 45.9053 172.8065 24 Q 5.3377 9.1764 123.7111 54.3912 31.6182 173.8330 25 A 5.3586 9.0444 127.8306 50.0445 21.6232 177.5604 26 S 4.5081 8.9028 115.2583 59.8322 63.2323 173.8781 27 Q 4.4715 7.6554 116.6926 54.9937 31.4372 173.2654 28 D 4.4944 8.6582 118.7750 55.2241 41.2815 176.2533 29 I 4.3165 8.6001 119.8489 59.9811 38.0180 176.0421 30 S 3.5364 9.1493 114.2626 60.2821 60.3356 172.8996 31 D 4.6243 7.9494 117.5059 54.9496 40.2001 174.7427 32 Y 4.2562 7.1338 119.5154 56.5798 36.3061 173.6536 33 L 5.0394 7.3218 122.9243 52.8947 46.2203 175.0880 34 I 4.9013 8.5919 125.6785 58.8818 41.5458 173.7433 35 W 5.1811 8.8352 128.0817 55.2255 31.7416 174.6630 36 Y 5.3865 9.3646 122.0985 56.2608 41.6235 174.3029 37 Q 4.4696 9.1024 121.6743 54.3008 32.2934 173.7960 38 Q 4.7904 8.9812 127.9472 54.1198 31.3900 174.9473 39 K 4.6053 8.4155 126.2179 55.1256 34.1446 176.4832 40 L 3.9307 8.3921 123.6506 56.6602 42.2306 176.8740 41 G 3.9368 8.9746 112.9572 46.0303 0.0000 172.7466 42 K 4.5969 7.6079 116.9372 53.7887 35.9623 175.8350 43 A 4.3151 8.1940 121.9254 50.9653 19.3844 175.6927 44 P 4.5943 0.0000 0.0000 62.7393 32.2985 175.8712 45 N 5.1568 9.3527 120.6773 51.3079 41.6676 173.6264 46 L 4.2780 8.6901 125.1817 55.1991 42.5540 175.7377 47 L 4.6465 8.9715 125.9114 56.0860 44.0626 176.6727 48 I 5.4258 7.6295 117.6565 59.8535 42.1319 173.8491 49 Y 5.0478 8.2667 122.4791 54.8861 42.2547 174.0953 50 D 4.7397 10.1033 114.5113 53.8914 40.3689 175.0586 51 A 4.1919 8.7451 125.8583 52.5237 18.3528 179.4637 52 S 5.1367 7.7109 105.1343 57.0315 64.9636 173.6346 53 T 4.1061 7.5305 117.3530 60.9010 67.5509 174.1862 54 L 4.6354 8.5233 129.0343 55.1354 42.7097 176.3990 55 E 4.9178 8.8138 122.4892 54.6784 32.0844 175.5100 56 T 4.0953 8.4012 114.4305 63.1017 69.1940 175.0664 57 G 3.9591 9.0066 113.1523 45.1792 0.0000 173.3472 58 V 4.0111 7.2815 119.8113 61.2746 31.8117 174.0316 59 P 4.4296 0.0000 0.0000 63.3505 31.7046 177.0054 60 S 4.4946 8.4688 115.5581 59.4148 63.2628 175.5804 61 R 3.8950 7.6459 117.3424 57.5352 29.6840 175.7139 62 F 5.1791 7.1927 117.7206 56.3432 40.4925 175.3183 63 S 4.6069 8.1652 115.9130 57.5397 67.0758 173.5496 64 G 4.4981 8.4782 107.4099 44.8508 0.0000 171.7716 65 S 5.2890 9.4700 119.2232 56.1030 66.9913 172.1572 66 G 4.2909 8.3263 105.1003 44.2393 0.0000 172.9963 67 S 4.3596 8.1128 113.1107 58.0356 68.0863 176.8360 68 G 4.5973 8.8293 111.9293 45.6928 0.0000 174.6022 69 T 4.5880 8.2966 112.0013 61.0849 73.0667 175.0365 70 E 5.0896 7.5772 122.0537 54.7573 31.6958 174.8977 71 Y 5.3718 9.7490 122.2976 56.4186 42.4134 174.6248 72 T 5.3605 9.3269 112.3496 59.9412 72.8786 172.3590 73 F 4.7244 9.1295 125.4367 56.5705 42.2043 173.6722 74 T 4.7808 8.0065 122.4857 61.6108 71.8264 173.2669 75 I 4.1335 8.1055 127.0304 59.3875 38.5252 176.4378 76 S 4.0090 8.9035 124.2834 60.8440 64.1453 174.3048 77 S 4.9317 7.5156 115.8927 54.7733 65.3575 172.8212 78 L 4.2652 9.0442 131.3972 55.4197 42.8974 175.7806 79 Q 4.9406 8.8732 124.7251 53.3336 31.5034 175.0854 80 P 4.2164 0.0000 0.0000 65.6182 31.5384 177.7427 81 E 4.4966 8.1613 113.3077 56.8529 29.7280 176.6335 82 D 4.8903 8.0957 119.1179 54.9893 41.5592 176.7738 83 I 3.8906 7.4370 119.7399 62.1165 37.4764 175.2075 84 A 4.3165 7.5604 124.5295 52.3369 24.9255 173.8031 85 T 4.8421 7.8342 112.4588 62.2661 71.3706 173.3749 86 Y 5.4485 8.8222 124.2279 56.0601 40.5508 174.5011 87 Y 5.5581 8.7133 119.1854 56.6338 42.9444 173.0775 88 C 4.7806 8.8785 117.1474 53.9365 42.8289 172.4422 89 Q 4.8552 8.2178 120.8924 54.7122 32.0186 173.2760 90 Q 4.8763 8.4805 124.3794 54.7076 31.0289 175.2287 91 Y 3.6441 7.8966 119.4287 56.7222 38.0332 176.4616 92 D 4.0962 8.2878 122.3723 57.5428 41.6740 175.7567 93 D 4.8338 7.8400 115.2621 52.5307 44.3221 174.1761 94 L 4.4058 8.2932 124.4513 53.3588 42.6674 175.0832 95 P 4.3713 0.0000 0.0000 62.2976 32.2694 175.5646 96 Y 4.6476 8.3472 119.5299 58.6266 38.4870 175.2844 97 T 4.8503 8.2447 111.6498 60.0382 71.7641 173.6063 98 F 5.1638 9.0034 121.8723 55.9481 41.8137 175.6947 99 G 4.0456 8.7923 110.3018 44.7615 0.0000 174.7754 100 Q 4.1771 8.5661 116.9494 56.4765 28.8965 177.3077 101 G 3.5739 8.1355 104.8255 45.7891 0.0000 173.1917 102 T 4.6923 8.4564 117.8464 61.2619 71.9445 173.0405 103 K 4.6644 8.9299 129.2113 55.8540 33.6003 175.7290 104 V 5.0731 8.9963 121.1256 59.7371 34.5087 174.7533 105 E 4.9097 9.0625 123.3410 54.6209 34.0114 174.7874 106 I 4.8562 8.1946 122.3827 59.4633 38.2959 176.1060 107 K 4.2816 9.6252 128.3290 57.1156 33.5459 177.6135 108 R 4.1836 8.1668 119.4407 56.8131 31.1590 175.0697 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 D 8.36 4.54 0.00 2.65 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 2 I 7.71 4.03 1.90 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 1.32 0.84 0.93 0.00 0.00 3 Q 9.79 4.53 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 4 M 8.68 5.16 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 5 T 8.87 4.60 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 1.26 0.00 0.00 6 Q 8.70 5.82 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 7 S 8.39 4.72 0.00 3.95 3.69 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 8 P 0.00 5.13 0.00 2.27 2.03 0.00 3.77 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 2.03 2.13 0.00 9 S 8.54 4.74 0.00 3.80 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 10 S 7.88 5.30 0.00 3.85 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 11 L 8.74 4.74 0.00 1.69 1.77 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.70 5.31 0.00 3.74 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 13 A 8.74 4.80 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 14 S 8.91 4.79 0.00 3.90 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 15 V 8.18 4.03 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 0.68 0.00 0.00 0.92 0.00 0.00 16 G 9.22 4.55 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 0.00 0.00 0.00 17 D 7.95 4.47 0.00 2.80 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 18 R 8.25 5.02 0.00 1.75 1.75 0.00 2.93 0.00 0.00 2.25 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.35 0.00 19 V 8.78 4.46 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 0.97 0.00 0.00 0.90 0.00 0.00 20 T 8.56 5.01 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 1.19 0.00 0.00 21 I 8.81 5.03 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.68 1.09 0.00 0.00 22 T 9.13 5.51 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 23 C 10.06 5.67 0.00 2.82 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 24 Q 9.18 5.34 0.00 2.37 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 25 A 9.04 5.36 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 26 S 8.90 4.51 0.00 3.91 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 27 Q 7.66 4.47 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 28 D 8.66 4.49 0.00 2.71 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 29 I 8.60 4.32 1.83 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.83 0.96 0.00 0.00 30 S 9.15 3.54 0.00 3.60 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 31 D 7.95 4.62 0.00 2.45 2.65 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 0.00 0.00 0.00 0.00 32 Y 7.13 4.26 0.00 2.65 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 33 L 7.32 5.04 0.00 0.85 0.86 0.45 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.59 4.90 1.58 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.09 0.58 0.00 0.00 35 W 8.84 5.18 0.00 3.32 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 36 Y 9.36 5.39 0.00 3.01 2.94 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 37 Q 9.10 4.47 0.00 1.95 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.00 1.53 0.00 38 Q 8.98 4.79 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 39 K 8.42 4.61 0.00 1.74 1.72 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.51 1.40 7.81 40 L 8.39 3.93 0.00 1.58 1.59 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.97 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 0.00 0.00 0.00 42 K 7.61 4.60 0.00 1.63 1.66 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.55 7.81 43 A 8.19 4.32 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 44 P 0.00 4.59 0.00 1.50 1.78 0.00 3.46 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 45 N 9.35 5.16 0.00 2.61 2.73 0.00 0.00 6.63 6.75 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 46 L 8.69 4.28 0.00 1.71 1.58 0.71 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.97 4.65 0.00 1.83 1.67 0.72 0.38 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 48 I 7.63 5.43 2.20 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.88 1.17 0.00 0.00 49 Y 8.27 5.05 0.00 2.95 2.83 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 50 D 10.10 4.74 0.00 2.88 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 51 A 8.75 4.19 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 52 S 7.71 5.14 0.00 3.94 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 53 T 7.53 4.11 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 0.24 0.00 0.00 54 L 8.52 4.64 0.00 1.59 1.66 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.81 4.92 0.00 2.28 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 0.00 2.27 2.34 0.00 56 T 8.40 4.10 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 1.26 0.00 0.00 57 G 9.01 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 0.00 0.00 0.00 58 V 7.28 4.01 2.33 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 0.98 0.00 0.00 1.04 0.00 0.00 59 P 0.00 4.43 0.00 2.21 1.98 0.00 4.15 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 60 S 8.47 4.49 0.00 3.84 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 61 R 7.65 3.90 0.00 1.71 1.93 0.00 2.64 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.78 0.00 62 F 7.19 5.18 0.00 3.12 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 63 S 8.17 4.61 0.00 3.79 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 64 G 8.48 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 65 S 9.47 5.29 0.00 3.87 3.97 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 66 G 8.33 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 67 S 8.11 4.36 0.00 3.71 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 68 G 8.83 4.60 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 69 T 8.30 4.59 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 1.35 0.00 0.00 70 E 7.58 5.09 0.00 1.79 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 0.00 2.22 2.38 0.00 71 Y 9.75 5.37 0.00 3.06 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 72 T 9.33 5.36 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 1.28 0.00 0.00 73 F 9.13 4.72 0.00 1.51 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 74 T 8.01 4.78 3.97 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 1.10 0.00 0.00 75 I 8.11 4.13 1.72 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 1.37 0.45 0.67 0.00 0.00 76 S 8.90 4.01 0.00 3.75 3.97 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 77 S 7.52 4.93 0.00 3.76 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 78 L 9.04 4.27 0.00 1.85 1.67 0.97 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.87 4.94 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 80 P 0.00 4.22 0.00 2.19 2.14 0.00 3.60 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 2.13 2.10 0.00 81 E 8.16 4.50 0.00 2.13 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 0.00 2.38 2.36 0.00 82 D 8.10 4.89 0.00 3.03 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 83 I 7.44 3.89 1.93 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 1.30 0.65 0.96 0.00 0.00 84 A 7.56 4.32 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.83 4.84 4.18 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 0.67 0.00 0.00 86 Y 8.82 5.45 0.00 2.85 2.67 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 0.00 0.00 0.00 87 Y 8.71 5.56 0.00 3.14 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 88 C 8.88 4.78 0.00 1.76 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 89 Q 8.22 4.86 0.00 0.99 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.87 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 90 Q 8.48 4.88 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 91 Y 7.90 3.64 0.00 1.71 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 0.00 0.00 0.00 0.00 92 D 8.29 4.10 0.00 2.88 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 93 D 7.84 4.83 0.00 2.63 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.29 4.41 0.00 1.61 1.45 0.77 0.16 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 95 P 0.00 4.37 0.00 2.19 2.02 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 96 Y 8.35 4.65 0.00 2.85 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 97 T 8.24 4.85 4.31 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 1.28 0.00 0.00 98 F 9.00 5.16 0.00 2.79 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 99 G 8.79 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 0.00 0.00 0.00 100 Q 8.57 4.18 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 101 G 8.14 3.57 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 0.00 0.00 0.00 102 T 8.46 4.69 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 1.28 0.00 0.00 103 K 8.93 4.66 0.00 1.88 1.69 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.49 7.81 104 V 9.00 5.07 2.25 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 1.06 0.00 0.00 1.10 0.00 0.00 105 E 9.06 4.91 0.00 1.92 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 2.24 2.28 0.00 106 I 8.19 4.86 1.90 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 1.42 0.44 0.92 0.00 0.00 107 K 9.63 4.28 0.00 1.60 1.86 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.43 7.81 108 R 8.17 4.18 0.00 1.77 1.80 0.00 3.25 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00