NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1741 8.1727 122.0490 56.2667 34.1390 174.0368 2 V 4.7204 8.1564 126.6959 60.6821 32.5645 174.4786 3 F 4.5098 10.1152 129.0110 57.5626 40.2533 174.9437 4 E 4.3312 9.3327 121.1027 55.5699 31.0854 176.8931 5 R 3.4045 9.0428 120.8268 60.8404 29.9531 179.4814 6 C 4.3646 8.0404 115.3156 59.5665 40.7121 175.7380 7 E 3.8968 8.1035 120.8137 59.2425 29.3535 178.4670 8 L 3.6087 8.0076 120.1088 57.8459 42.0634 178.5729 9 A 3.9452 7.7715 120.7416 55.4671 18.2372 179.9304 10 R 3.9194 8.0357 116.4195 59.4604 30.0346 179.4164 11 T 3.8543 7.8884 115.6356 66.6775 68.5472 176.7136 12 L 3.8531 8.2388 121.2599 57.4438 41.5887 179.4039 13 K 3.8975 8.1008 119.5994 59.7428 31.9434 179.1232 14 R 4.0137 8.0130 117.1050 58.8169 29.9858 178.0612 15 L 4.3842 7.3479 116.1451 54.3148 41.6593 177.1956 16 G 3.8857 7.7819 106.8953 46.6746 0.0000 175.0032 17 M 3.9621 7.7889 120.6481 56.3238 32.3082 175.6804 18 D 4.3778 8.0014 117.7241 56.0661 40.7134 175.6100 19 G 3.9369 9.3396 115.5012 45.2672 0.0000 171.0260 20 Y 4.2115 8.2070 121.5945 58.7685 38.9393 176.4775 21 R 3.5633 8.9742 127.0956 57.2895 27.7989 177.2433 22 G 3.8041 8.1964 103.0205 45.7885 0.0000 173.9977 23 I 4.0564 7.6170 122.1532 59.1451 38.0750 175.9543 24 S 4.6636 8.2806 120.2746 57.6407 63.9594 174.9407 25 L 4.2309 8.8753 122.7201 58.5162 41.8133 179.0786 26 A 4.1165 8.1282 120.1918 55.2557 18.2854 179.2752 27 N 4.4385 8.0543 114.6456 56.3559 38.5726 177.7414 28 W 4.2818 8.0163 119.8855 59.9117 29.0642 178.4064 29 M 4.1290 8.4910 119.0233 58.5970 31.4533 177.9697 30 C 3.2308 8.0056 118.5883 58.9928 43.9978 175.3367 31 L 4.0021 8.1352 122.0056 58.3929 41.7851 179.0338 32 S 4.3316 8.4085 115.2325 61.5075 62.8106 176.6403 33 K 3.0218 8.3054 122.2965 59.2980 31.7302 178.9590 34 W 4.1831 7.7459 117.2951 59.2358 29.0240 178.2900 35 E 4.3706 8.4117 118.8249 58.6635 29.0893 177.7963 36 S 4.5127 7.9846 108.8967 56.8588 65.0913 174.3134 37 G 3.2517 8.2687 108.8469 47.0458 0.0000 173.3944 38 Y 3.6817 7.7052 113.3126 58.6873 35.3968 168.7818 39 N 5.3112 7.6905 118.9857 51.9850 40.1025 175.3667 40 T 4.1157 9.1765 117.8756 63.5782 69.9323 175.8680 41 R 4.5470 8.0175 117.3893 55.7688 30.4470 176.5415 42 A 4.3743 7.8257 122.9925 52.9028 19.4082 177.3876 43 T 5.1004 8.2635 110.1907 60.3493 72.5125 173.0204 44 N 4.8690 8.7487 121.9377 52.5669 42.1068 172.4427 45 Y 4.7384 8.7691 127.8237 57.0556 41.0341 173.8832 46 N 4.7058 8.4344 124.3867 51.0833 39.0155 175.2525 47 A 3.6366 8.2362 127.6260 54.6660 19.0129 179.3254 48 G 3.6906 8.1016 104.4325 48.2699 0.0000 174.1382 49 D 4.7720 7.7388 117.1418 51.9212 39.8007 176.1788 50 R 4.1338 7.9887 115.9128 56.7450 28.2993 175.9144 51 S 4.9847 7.3068 111.9082 57.0913 66.4958 172.6965 52 T 5.1297 8.8280 115.7511 61.9796 72.7993 172.8171 53 D 5.4899 9.0698 125.2386 53.2003 43.1663 175.0966 54 Y 5.0115 9.1460 120.9810 57.4902 41.6953 177.3846 55 G 4.4190 8.9395 111.3793 46.2081 0.0000 173.5737 56 I 3.8803 8.0962 116.8447 62.8508 37.9656 177.4766 57 F 4.7415 7.7849 115.7598 56.4233 39.9646 175.1794 58 Q 3.5861 7.8474 119.3129 57.0741 26.5908 174.0942 59 I 4.3962 8.1405 118.9430 61.0007 39.3338 176.9686 60 N 5.3983 9.1821 126.0678 53.4778 39.7657 175.7828 61 S 4.5845 9.1193 120.4217 60.8979 63.4559 175.4333 62 R 3.7550 8.8388 122.2706 58.7672 30.3702 177.8515 63 Y 4.3894 7.8597 114.1557 57.5644 40.7129 176.7998 64 W 5.1498 8.1282 118.6711 57.7015 31.1094 173.9994 65 C 5.6048 8.1819 111.6677 53.8605 45.1813 172.8475 66 N 5.0553 8.9648 119.0651 52.0082 40.0874 174.7384 67 D 4.8269 8.7648 123.7676 52.2026 40.3355 177.0075 68 G 3.9520 8.5756 107.2605 46.2779 0.0000 174.4518 69 K 4.5248 8.1787 116.4626 56.4480 33.2674 175.6572 70 T 4.6099 7.6835 117.0684 61.2880 69.6188 172.2027 71 P 4.2764 0.0000 0.0000 64.1590 31.6300 176.1062 72 G 3.9003 8.9459 109.7338 46.1974 0.0000 173.1086 73 A 4.2427 7.5235 119.8203 51.7841 19.2266 177.6923 74 V 4.3070 8.3565 112.5761 59.3529 35.4629 176.2303 75 N 4.9347 8.0326 117.2378 51.9951 37.8351 174.4642 76 A 3.9697 9.1274 125.3268 54.7905 19.0696 178.4814 77 C 4.5828 8.5082 111.0810 57.2855 41.1248 173.0303 78 H 4.0302 7.8007 116.5209 56.6212 26.4233 174.2988 79 L 4.8345 8.2292 117.4568 52.8237 46.4310 176.8138 80 S 4.6057 8.3699 115.6155 58.0628 63.2759 176.0148 81 C 4.1440 8.7859 124.1568 59.6044 40.4486 176.3974 82 S 3.8786 7.8681 114.8962 61.2132 61.6609 175.9092 83 A 4.0316 7.7701 122.5643 54.4417 17.9195 177.9399 84 L 4.4576 7.7913 116.2826 55.0625 41.8077 177.5480 85 L 5.0214 7.9300 117.6803 54.5598 42.3511 176.5922 86 Q 4.4293 7.8288 117.3432 55.1074 29.7799 175.9555 87 D 4.4150 8.5655 120.3972 57.1750 41.1519 176.8840 88 N 4.5791 8.0199 118.0075 53.2503 39.4582 174.6964 89 I 4.2568 8.4404 118.4610 60.9519 38.0330 177.0756 90 A 3.9479 8.2958 124.7677 56.0435 18.1581 180.1325 91 D 4.2994 8.0930 116.4698 57.3326 40.9474 178.7042 92 A 4.1040 7.9819 120.9933 55.1470 18.3842 179.7131 93 V 3.3994 8.3124 117.0173 65.8997 31.5646 178.0974 94 A 3.8257 8.0760 120.6394 55.2478 18.1295 178.8556 95 C 4.2106 8.4224 116.7997 59.7841 40.3641 175.5356 96 A 3.9095 8.3336 122.7857 55.1003 17.5516 179.7809 97 K 3.7439 7.6885 116.2842 59.4669 32.2106 179.1425 98 R 4.0909 7.8348 119.0172 59.3197 30.0208 178.5631 99 V 2.4947 7.6801 118.1902 65.8630 30.9391 178.1294 100 V 3.8836 7.7710 110.2141 62.8425 31.2789 177.9743 101 R 4.2225 7.6076 117.3280 57.0139 30.5491 176.3300 102 D 4.7342 7.5928 119.4656 52.6601 42.0049 175.4676 103 P 4.2179 0.0000 0.0000 66.1790 31.5301 178.3786 104 Q 4.0034 8.1713 116.2344 56.7662 29.9136 177.6335 105 G 3.6891 7.8801 106.9617 46.7780 0.0000 175.9264 106 I 3.5006 7.7784 119.9339 63.4770 37.9271 177.8654 107 R 4.1657 7.2335 117.1191 57.5649 30.0059 177.3160 108 A 4.0741 7.5090 120.7715 53.6463 18.7016 177.7774 109 W 4.6279 7.9585 116.3983 55.5005 29.6127 177.4923 110 V 3.7423 8.7259 123.8615 66.0098 30.9291 177.6055 111 A 4.0299 8.3023 120.1670 54.7850 18.1505 179.2859 112 W 3.9839 8.4232 126.6470 60.6664 30.6101 178.4307 113 R 3.8029 8.2948 116.3542 59.3185 29.6582 178.3981 114 N 4.3817 8.2568 115.2100 55.7312 38.7296 176.8833 115 R 4.1342 7.7972 115.4130 55.9257 31.1878 175.8920 116 C 4.5015 7.8835 115.8407 57.5087 42.9760 174.4695 117 Q 3.2038 6.5953 119.8416 56.9192 28.7864 175.1280 118 N 4.1684 8.5954 121.0606 54.3522 36.2210 173.8654 119 R 4.4792 7.2917 115.0638 54.1615 33.0031 175.8978 120 D 4.5798 8.4037 119.0822 53.9117 40.1810 175.6846 121 V 4.6356 8.1156 118.5003 61.1299 32.3535 178.4153 122 R 4.0294 8.1691 122.8809 59.3315 30.0110 178.9257 123 Q 4.0209 8.1678 114.4958 59.2741 28.3501 177.6970 124 Y 4.2925 7.9528 115.6064 60.0894 38.3028 176.8018 125 V 4.4225 7.8741 110.7381 60.6611 33.0440 175.4268 126 Q 4.2240 7.9759 120.2685 57.2390 28.8505 176.8105 127 G 3.9609 8.9733 110.6533 45.8652 0.0000 174.3776 128 C 4.4721 8.0011 115.5223 56.4499 40.6006 173.8765 129 G 3.8729 8.0881 107.2837 46.8116 0.0000 174.2676 130 V 4.0059 7.9078 118.0523 61.0750 32.0302 175.8830 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 K 8.17 4.17 0.00 2.02 1.61 0.00 1.22 0.00 0.00 0.87 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.14 7.81 2 V 8.16 4.72 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.12 4.51 0.00 2.84 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 4 E 9.33 4.33 0.00 1.94 1.88 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 2.32 2.26 0.00 5 R 9.04 3.40 0.00 2.00 1.95 0.00 3.39 0.00 0.00 3.44 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 6 C 8.04 4.36 0.00 3.01 3.12 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 0.00 0.00 0.00 7 E 8.10 3.90 0.00 2.06 2.26 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 2.62 2.42 0.00 8 L 8.01 3.61 0.00 1.35 1.35 -0.18 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.77 3.95 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 10 R 8.04 3.92 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.89 3.85 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 1.25 0.00 0.00 12 L 8.24 3.85 0.00 1.68 1.54 0.88 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.10 3.90 0.00 1.96 1.94 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.01 4.01 0.00 1.94 1.97 0.00 3.21 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 15 L 7.35 4.38 0.00 1.60 1.57 0.89 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.78 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 17 M 7.79 3.96 0.00 1.38 1.98 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 18 D 8.00 4.38 0.00 2.69 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 19 G 9.34 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 20 Y 8.21 4.21 0.00 3.40 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 21 R 8.97 3.56 0.00 1.87 1.83 0.00 3.26 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 1.36 0.00 22 G 8.20 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 23 I 7.62 4.06 1.76 0.00 0.00 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 0.89 0.75 -0.34 0.00 0.00 24 S 8.28 4.66 0.00 4.05 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 25 L 8.88 4.23 0.00 2.04 1.80 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.13 4.12 1.50 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 27 N 8.05 4.44 0.00 2.82 2.75 0.00 0.00 6.96 7.15 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 28 W 8.02 4.28 0.00 3.50 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 29 M 8.49 4.13 0.00 2.16 2.33 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 2.70 2.93 0.00 30 C 8.01 3.23 0.00 2.48 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 31 L 8.14 4.00 0.00 1.88 1.87 0.62 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.41 4.33 0.00 4.27 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 33 K 8.31 3.02 0.00 1.67 1.76 0.00 0.71 0.00 0.00 0.99 0.00 0.00 2.57 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.28 0.38 7.81 34 W 7.75 4.18 0.00 3.45 3.30 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 35 E 8.41 4.37 0.00 2.03 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 2.59 2.43 0.00 36 S 7.98 4.51 0.00 4.08 4.12 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 0.00 0.00 0.00 37 G 8.27 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 0.00 0.00 0.00 38 Y 7.71 3.68 0.00 3.27 3.01 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 39 N 7.69 5.31 0.00 2.80 2.86 0.00 0.00 7.01 6.88 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 40 T 9.18 4.12 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 1.45 0.00 0.00 41 R 8.02 4.55 0.00 1.89 2.08 0.00 3.08 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.79 0.00 42 A 7.83 4.37 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 43 T 8.26 5.10 4.12 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 0.00 0.00 1.30 0.00 0.00 44 N 8.75 4.87 0.00 2.86 2.86 0.00 0.00 6.89 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 45 Y 8.77 4.74 0.00 3.01 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 46 N 8.43 4.71 0.00 2.62 2.59 0.00 0.00 6.69 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 47 A 8.24 3.64 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 48 G 8.10 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 0.00 0.00 0.00 49 D 7.74 4.77 0.00 2.75 2.81 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 50 R 7.99 4.13 0.00 2.04 2.17 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 51 S 7.31 4.98 0.00 4.16 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 52 T 8.83 5.13 4.12 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 0.00 0.00 0.65 0.00 0.00 53 D 9.07 5.49 0.00 2.69 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 54 Y 9.15 5.01 0.00 2.91 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 55 G 8.94 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 0.00 0.00 0.00 0.00 56 I 8.10 3.88 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.79 -0.16 0.00 0.00 57 F 7.78 4.74 0.00 3.23 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 58 Q 7.85 3.59 0.00 2.52 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.82 0.00 0.00 0.00 0.00 0.00 2.51 2.71 0.00 59 I 8.14 4.40 2.15 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.16 1.13 0.00 0.00 60 N 9.18 5.40 0.00 3.12 3.07 0.00 0.00 6.98 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 61 S 9.12 4.58 0.00 4.08 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 0.00 62 R 8.84 3.75 0.00 1.60 1.31 0.00 2.71 0.00 0.00 2.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 63 Y 7.86 4.39 0.00 1.56 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 0.00 0.00 0.00 64 W 8.13 5.15 0.00 3.58 3.32 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 65 C 8.18 5.60 0.00 3.04 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 66 N 8.96 5.06 0.00 2.84 2.69 0.00 0.00 7.08 8.04 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 67 D 8.76 4.83 0.00 2.84 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 68 G 8.58 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 69 K 8.18 4.52 0.00 1.86 1.87 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.44 7.81 70 T 7.68 4.61 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 1.22 0.00 0.00 71 P 0.00 4.28 0.00 2.01 2.01 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.95 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 0.00 0.00 0.00 73 A 7.52 4.24 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 74 V 8.36 4.31 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 0.61 0.00 0.00 0.83 0.00 0.00 75 N 8.03 4.93 0.00 2.74 2.55 0.00 0.00 6.77 8.48 0.00 0.00 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 A 9.13 3.97 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 77 C 8.51 4.58 0.00 3.32 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 78 H 7.80 4.03 0.00 3.31 3.37 0.00 5.79 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 79 L 8.23 4.83 0.00 1.69 1.50 1.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.37 4.61 0.00 3.83 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 81 C 8.79 4.14 0.00 2.27 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 82 S 7.87 3.88 0.00 3.88 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 83 A 7.77 4.03 1.39 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 0.00 0.00 0.00 84 L 7.79 4.46 0.00 1.92 1.81 1.08 0.45 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 85 L 7.93 5.02 0.00 1.75 1.68 1.10 1.16 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 86 Q 7.83 4.43 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 7.08 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 87 D 8.57 4.42 0.00 2.62 2.66 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 88 N 8.02 4.58 0.00 2.69 2.74 0.00 0.00 6.93 7.94 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 89 I 8.44 4.26 1.76 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 1.60 0.99 0.97 0.00 0.00 90 A 8.30 3.95 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 91 D 8.09 4.30 0.00 2.75 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 92 A 7.98 4.10 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 93 V 8.31 3.40 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 0.78 0.00 0.00 0.93 0.00 0.00 94 A 8.08 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.42 4.21 0.00 3.17 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 96 A 8.33 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.69 3.74 0.00 1.62 1.43 0.00 1.30 0.00 0.00 0.84 0.00 0.00 2.34 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.88 7.81 98 R 7.83 4.09 0.00 2.01 2.18 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.03 0.00 99 V 7.68 2.49 1.88 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 -0.31 0.00 0.00 -0.35 0.00 0.00 100 V 7.77 3.88 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 1.18 0.00 0.00 1.47 0.00 0.00 101 R 7.61 4.22 0.00 1.99 2.05 0.00 3.24 0.00 0.00 3.40 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.14 0.00 102 D 7.59 4.73 0.00 3.08 2.64 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 0.00 103 P 0.00 4.22 0.00 2.01 2.13 0.00 3.69 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 2.03 2.14 0.00 104 Q 8.17 4.00 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.88 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 0.00 0.00 0.00 106 I 7.78 3.50 1.02 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 -0.36 -0.65 0.00 0.00 107 R 7.23 4.17 0.00 1.99 2.01 0.00 3.21 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.46 0.00 108 A 7.51 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.96 4.63 0.00 3.57 3.27 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 0.00 110 V 8.73 3.74 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 1.19 0.00 0.00 0.99 0.00 0.00 111 A 8.30 4.03 1.54 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 0.00 112 W 8.42 3.98 0.00 3.52 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 0.00 113 R 8.29 3.80 0.00 2.10 2.02 0.00 3.63 0.00 0.00 3.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.21 0.00 114 N 8.26 4.38 0.00 2.67 2.72 0.00 0.00 6.94 8.40 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 0.00 115 R 7.80 4.13 0.00 0.78 0.79 0.00 2.85 0.00 0.00 2.91 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.95 0.00 116 C 7.88 4.50 0.00 1.49 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 0.00 117 Q 6.60 3.20 0.00 0.93 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.89 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 118 N 8.60 4.17 0.00 2.79 2.81 0.00 0.00 6.90 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 0.00 119 R 7.29 4.48 0.00 1.75 1.78 0.00 3.22 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 120 D 8.40 4.58 0.00 2.64 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 0.00 121 V 8.12 4.64 2.35 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 0.81 0.00 0.00 1.03 0.00 0.00 122 R 8.17 4.03 0.00 1.92 2.02 0.00 3.27 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.17 4.02 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.12 0.00 0.00 0.00 0.00 0.00 2.10 1.57 0.00 124 Y 7.95 4.29 0.00 3.27 3.15 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 0.00 125 V 7.87 4.42 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 1.01 0.00 0.00 1.05 0.00 0.00 126 Q 7.98 4.22 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.71 0.00 0.00 0.00 0.00 0.00 2.48 2.31 0.00 127 G 8.97 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 0.00 128 C 8.00 4.47 0.00 3.03 3.14 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 0.00 129 G 8.09 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 0.00 130 V 7.91 4.01 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 0.80 0.00 0.00 0.96 0.00 0.00