NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2673 8.4449 121.4841 55.7313 31.3553 175.7545 3 Q 4.5419 7.9220 121.2235 53.9542 30.2115 173.8114 4 Y 3.1641 9.0328 124.0813 56.8500 38.9893 173.7560 5 Y 5.3584 8.3629 126.0968 55.0657 41.0824 175.0831 6 G 3.9827 7.3868 111.2214 44.8684 0.0000 171.5170 7 T 4.5647 8.1889 117.6521 61.2415 70.5851 174.1863 8 G 4.2772 8.6552 114.8074 45.6265 0.0000 171.5974 9 R 4.9388 8.1747 122.5586 55.0186 33.3774 174.9733 10 R 4.0278 8.8865 123.9355 56.0132 32.5791 172.9984 11 K 3.3726 8.5820 127.1198 57.2423 30.5178 175.8296 12 E 3.6144 8.5122 128.8235 56.4245 26.6658 178.1754 13 A 4.4094 7.2134 122.8166 51.8915 20.4416 176.1247 14 V 4.6123 8.0708 121.8288 62.3999 34.5843 174.3520 15 A 5.0104 8.8319 124.9417 50.7002 22.9406 175.6242 16 R 4.5568 9.0726 122.3010 55.2350 32.4033 175.7199 17 V 4.4828 8.0211 122.8811 61.0167 34.4468 173.9817 18 F 5.7805 9.1155 126.8842 55.9057 41.6673 174.5171 19 L 5.1847 8.5747 123.3768 53.2082 45.3899 176.0097 20 R 4.8817 8.2037 120.6272 54.2679 34.9942 172.9603 21 P 3.9529 0.0000 0.0000 62.5015 32.0101 177.2607 22 G 4.1157 8.5238 108.5529 45.8865 0.0000 171.2029 23 N 4.2730 8.7593 117.0661 57.9011 38.6504 174.5241 24 G 3.9969 8.2488 109.1208 45.8982 0.0000 174.1339 25 K 4.2679 7.2133 119.4348 54.3752 33.6909 175.2639 26 V 4.6443 8.6412 125.3106 61.4370 33.6132 174.2437 27 T 5.2091 8.6303 124.5716 62.2003 71.3631 173.8691 28 V 4.9734 8.8228 123.6689 62.7435 35.4296 174.1267 29 N 4.1382 9.2745 125.5537 54.5860 36.5704 174.6222 30 G 3.8918 7.8656 101.8216 44.9502 0.0000 172.4636 31 Q 4.4361 7.1645 118.0193 55.5766 33.4669 172.1827 32 D 4.7637 8.2223 121.8307 53.5220 41.9319 176.2854 33 F 3.9965 8.7863 128.0076 62.5329 39.5921 177.5379 34 N 4.6696 8.3654 115.0196 53.5831 37.9579 175.6113 35 E 4.4541 8.1038 120.3879 57.7999 31.5943 176.6510 36 Y 4.4159 7.8700 117.7136 59.3646 38.8173 175.2694 37 F 4.8994 7.3934 119.0159 56.7378 39.3676 175.9722 38 Q 4.1373 7.9047 122.5198 59.9893 28.4190 173.4816 39 G 4.1418 9.0382 115.8180 46.0362 0.0000 172.6022 40 L 3.8386 7.3487 121.6032 54.6923 41.4735 178.3847 41 V 3.6312 8.2906 124.2584 65.0551 31.6590 176.4398 42 R 4.1413 7.7165 117.2076 56.2467 30.1575 176.4205 43 A 3.6023 7.2876 119.7543 56.8625 18.5644 179.6881 44 V 3.9277 7.8447 105.4272 62.6849 32.1993 177.3756 45 A 4.2108 8.7699 125.5597 54.5994 18.8478 180.0510 46 A 3.9402 8.2751 117.6403 55.3284 18.6071 178.1549 47 L 4.1732 7.7564 113.0849 55.1058 42.0271 178.1354 48 E 3.9748 8.3478 121.6409 58.6406 29.6046 176.7264 49 P 3.8465 0.0000 0.0000 65.0845 31.0330 178.4262 50 L 4.0009 7.7111 119.5562 57.8021 41.5679 179.3207 51 R 4.2015 7.8046 117.0430 58.5471 29.7215 177.8548 52 A 4.4625 7.4145 117.3448 52.5922 18.8971 177.8663 53 V 4.5347 8.1655 108.6663 60.4561 34.5177 174.5729 54 D 5.0474 7.8731 117.7124 54.5199 40.2625 176.1260 55 A 4.5163 7.5757 121.3863 51.9180 16.7225 177.5507 56 L 4.1320 7.7445 123.6915 57.4753 43.2743 177.5077 57 G 4.2213 7.5790 106.0492 44.6440 0.0000 173.4265 58 R 4.6680 8.2479 116.5362 55.5735 32.7930 176.7416 59 F 4.9103 8.3088 117.3555 55.7651 42.9751 173.9100 60 D 5.2888 9.8223 122.7489 51.8024 41.4030 173.8435 61 A 4.6652 8.2463 123.6003 51.7105 19.6937 175.7177 62 Y 4.9832 9.4671 125.4075 57.4613 39.9774 174.4144 63 I 4.5314 8.7439 128.1334 59.4198 41.2586 174.7758 64 T 4.5897 8.1338 120.8700 60.2921 69.3310 172.7741 65 V 4.7382 8.6723 129.4227 60.1355 33.6473 175.7321 66 R 4.5726 9.2931 122.1971 55.9520 34.6980 175.1814 67 G 4.0929 9.3499 110.7782 46.4230 0.0000 174.7527 68 G 3.8653 8.3925 109.7628 46.8169 0.0000 175.5978 69 G 4.2506 8.1990 111.4805 41.5092 0.0000 172.1598 70 K 3.8273 8.5950 119.0810 59.5896 31.7346 179.5712 71 S 3.9677 7.8592 112.7249 61.2531 62.7030 176.2356 72 G 3.6284 8.0376 107.7355 47.7642 0.0000 175.4381 73 Q 4.1019 7.9815 119.9102 58.8964 28.9724 178.4281 74 I 3.7210 7.4476 120.4161 64.5280 36.7263 178.2659 75 D 4.3648 8.4294 119.8005 57.0337 40.5218 178.5845 76 A 3.9942 7.8319 120.9594 55.2313 18.4552 179.3503 77 I 3.5599 8.4175 118.5674 64.7464 37.3954 178.2027 78 K 3.8210 7.8723 119.5289 59.4622 31.8685 178.5186 79 L 3.9355 7.4984 119.1336 58.1388 42.0613 178.9818 80 G 3.5622 7.9796 105.1523 47.8568 0.0000 175.3323 81 I 3.5010 7.7514 121.8914 64.0568 35.8094 178.1433 82 A 4.0491 7.7174 119.7471 53.6236 18.4139 178.7053 83 R 4.2232 7.8846 116.6361 57.5981 30.3749 177.8793 84 A 4.2458 8.0007 121.1514 54.3029 18.4761 178.7743 85 L 4.1032 7.5074 116.7416 57.2442 40.9941 178.6550 86 V 4.0735 7.0429 117.0933 63.3863 32.0133 177.8064 87 Q 4.1582 7.4362 118.6538 58.8594 29.7579 177.0006 88 Y 4.3103 8.5341 116.6151 56.3068 38.4767 176.3828 89 N 5.1733 7.6544 131.0116 53.3588 39.2755 174.8425 90 P 4.8280 0.0000 0.0000 63.1971 31.0527 177.9268 91 D 4.8059 8.9392 121.8045 56.6947 40.8065 177.3834 92 Y 4.8738 8.3402 117.3599 58.1580 37.5255 177.3960 93 R 4.3421 8.0833 121.4290 58.2365 31.5674 176.0629 94 A 4.6151 7.2504 122.3408 49.0890 17.1927 175.7118 95 K 4.4229 7.1915 130.2243 57.0485 34.9039 177.8782 96 L 4.1459 7.2510 120.6413 57.2176 42.6523 178.3880 97 K 4.1494 7.9344 118.1862 58.2102 32.6168 176.4413 98 P 4.1421 0.0000 0.0000 65.6958 31.3033 177.5788 99 L 3.7103 7.6233 118.3962 55.2531 41.9849 175.5939 100 G 3.7792 7.7538 109.1824 46.6443 0.0000 173.2395 101 F 5.2811 10.1308 120.5487 56.9524 41.8059 175.5055 102 L 4.6678 7.5055 122.7315 52.9720 42.2824 174.6435 103 T 4.2857 8.2917 115.4673 62.4779 72.4551 174.0671 104 R 3.8678 9.1526 125.4994 58.4912 30.8194 176.2252 105 D 4.2311 8.2125 112.8016 55.4933 37.5812 173.6955 106 A 4.2251 7.8862 118.3097 52.5767 18.7273 178.2104 107 R 4.1086 7.6349 117.3145 56.5944 30.3710 176.7878 108 V 4.3810 7.9664 115.1734 59.0460 35.6173 174.5731 109 V 3.5609 8.4952 123.0690 63.0439 30.8649 175.6528 110 E 4.1696 8.6162 124.9636 55.6343 30.3860 176.3262 111 R 3.7981 7.7941 120.7792 55.1492 31.7407 175.0008 112 K 4.5536 8.2989 122.1722 54.5079 34.2754 175.6321 113 K 4.5316 8.3621 124.3576 54.8473 34.4019 174.7764 114 Y 4.5977 9.1049 117.1464 57.0656 39.3527 175.9827 115 G 4.4265 8.9376 109.0705 46.4617 0.0000 173.9261 116 K 4.4654 7.5103 116.7545 61.6276 33.1540 180.4228 117 H 3.8741 7.7194 114.7301 58.0946 29.5759 176.4106 118 K 4.4847 8.1364 121.0692 55.1275 32.7704 177.0402 119 A 4.3969 8.4001 128.3108 53.1539 18.3454 178.9482 120 R 4.3181 9.4767 110.1055 57.6364 33.3249 174.2440 121 R 3.8471 8.1902 119.1693 56.2442 29.3674 175.2189 122 A 4.2948 8.2079 127.5345 50.6114 19.3709 175.5825 123 P 4.5559 0.0000 0.0000 62.1187 32.2012 176.3983 124 Q 3.9236 8.7007 118.6296 56.6850 28.9489 176.2602 125 Y 4.3060 8.6315 124.2063 57.5782 38.6034 174.6314 126 S 4.2053 8.4426 126.4688 55.7934 63.6307 176.1389 127 K 4.4433 8.3925 128.6440 57.0734 32.7916 176.4501 128 R 4.1598 8.1938 119.0440 56.1739 29.5954 175.9630 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 E 8.44 4.27 0.00 1.98 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 0.00 2.22 2.37 0.00 3 Q 7.92 4.54 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.90 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 4 Y 9.03 3.16 0.00 2.65 2.58 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 5 Y 8.36 5.36 0.00 3.12 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 6 G 7.39 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 7 T 8.19 4.56 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 1.29 0.00 0.00 8 G 8.66 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 0.00 0.00 0.00 0.00 9 R 8.17 4.94 0.00 1.78 1.76 0.00 3.29 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 10 R 8.89 4.03 0.00 1.74 1.82 0.00 3.38 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.53 0.00 11 K 8.58 3.37 0.00 1.85 1.81 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.44 7.81 12 E 8.51 3.61 0.00 2.08 2.24 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 2.26 2.25 0.00 13 A 7.21 4.41 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 14 V 8.07 4.61 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 1.08 0.00 0.00 0.94 0.00 0.00 15 A 8.83 5.01 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 16 R 9.07 4.56 0.00 1.52 1.62 0.00 3.10 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.64 0.00 17 V 8.02 4.48 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 0.88 0.00 0.00 0.77 0.00 0.00 18 F 9.12 5.78 0.00 3.31 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 19 L 8.57 5.18 0.00 1.62 1.31 0.60 0.57 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 20 R 8.20 4.88 0.00 1.94 1.78 0.00 3.31 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.89 0.00 21 P 0.00 3.95 0.00 1.77 1.63 0.00 3.82 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.55 0.00 22 G 8.52 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 0.00 0.00 0.00 23 N 8.76 4.27 0.00 2.72 2.94 0.00 0.00 6.81 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 24 G 8.25 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 25 K 7.21 4.27 0.00 1.88 1.97 0.00 1.48 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.56 7.81 26 V 8.64 4.64 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 0.99 0.00 0.00 0.82 0.00 0.00 27 T 8.63 5.21 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 28 V 8.82 4.97 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 0.92 0.00 0.00 0.94 0.00 0.00 29 N 9.27 4.14 0.00 2.36 2.47 0.00 0.00 7.05 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 30 G 7.87 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 31 Q 7.16 4.44 0.00 1.72 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.95 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 32 D 8.22 4.76 0.00 2.78 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 33 F 8.79 4.00 0.00 3.21 3.08 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 0.00 0.00 0.00 0.00 34 N 8.37 4.67 0.00 2.78 2.82 0.00 0.00 6.89 7.33 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 35 E 8.10 4.45 0.00 1.88 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 2.22 2.21 0.00 36 Y 7.87 4.42 0.00 2.65 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 37 F 7.39 4.90 0.00 2.73 2.52 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 38 Q 7.90 4.14 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.95 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 39 G 9.04 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 40 L 7.35 3.84 0.00 1.70 1.44 0.50 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.29 3.63 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 0.74 0.00 0.00 0.90 0.00 0.00 42 R 7.72 4.14 0.00 1.73 1.78 0.00 3.27 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 43 A 7.29 3.60 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 44 V 7.84 3.93 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 0.84 0.00 0.00 0.98 0.00 0.00 45 A 8.77 4.21 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 46 A 8.28 3.94 1.53 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 47 L 7.76 4.17 0.00 1.66 1.55 -0.08 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.35 3.97 0.00 2.22 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 0.00 2.43 2.54 0.00 49 P 0.00 3.85 0.00 1.88 1.30 0.00 3.49 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.76 0.00 50 L 7.71 4.00 0.00 1.79 1.78 0.77 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 51 R 7.80 4.20 0.00 1.95 2.03 0.00 3.16 0.00 0.00 3.37 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 52 A 7.41 4.46 1.55 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 53 V 8.17 4.53 2.41 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 1.03 0.00 0.00 1.01 0.00 0.00 54 D 7.87 5.05 0.00 2.99 3.16 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 55 A 7.58 4.52 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 56 L 7.74 4.13 0.00 1.64 1.73 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.58 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 0.00 0.00 0.00 0.00 58 R 8.25 4.67 0.00 1.85 1.70 0.00 3.21 0.00 0.00 3.36 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 59 F 8.31 4.91 0.00 2.76 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 60 D 9.82 5.29 0.00 2.57 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 61 A 8.25 4.67 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 62 Y 9.47 4.98 0.00 3.09 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 63 I 8.74 4.53 1.74 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.79 0.84 0.00 0.00 64 T 8.13 4.59 3.83 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 0.91 0.00 0.00 65 V 8.67 4.74 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 0.90 0.00 0.00 1.04 0.00 0.00 66 R 9.29 4.57 0.00 1.70 1.79 0.00 3.04 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 67 G 9.35 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 68 G 8.39 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 69 G 8.20 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 70 K 8.59 3.83 0.00 1.62 1.56 0.00 1.49 0.00 0.00 1.43 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.44 7.81 71 S 7.86 3.97 0.00 3.75 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 72 G 8.04 3.63 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 0.00 73 Q 7.98 4.10 0.00 2.44 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.48 2.67 0.00 74 I 7.45 3.72 1.82 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.70 0.83 0.00 0.00 75 D 8.43 4.36 0.00 2.83 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 76 A 7.83 3.99 1.42 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 77 I 8.42 3.56 2.11 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.87 0.92 0.00 0.00 78 K 7.87 3.82 0.00 1.77 1.99 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.13 7.81 79 L 7.50 3.94 0.00 1.74 1.72 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.98 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.75 3.50 1.79 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.00 0.66 0.00 0.00 82 A 7.72 4.05 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 83 R 7.88 4.22 0.00 1.90 2.00 0.00 3.20 0.00 0.00 3.15 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 84 A 8.00 4.25 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 85 L 7.51 4.10 0.00 1.49 1.57 1.05 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.04 4.07 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 0.80 0.00 0.00 1.00 0.00 0.00 87 Q 7.44 4.16 0.00 2.36 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.62 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 88 Y 8.53 4.31 0.00 3.24 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 89 N 7.65 5.17 0.00 2.70 2.55 0.00 0.00 6.74 8.03 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 90 P 0.00 4.83 0.00 2.21 2.17 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 91 D 8.94 4.81 0.00 2.82 2.76 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 92 Y 8.34 4.87 0.00 3.22 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 93 R 8.08 4.34 0.00 1.94 1.94 0.00 3.27 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 94 A 7.25 4.62 1.24 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 0.00 0.00 95 K 7.19 4.42 0.00 2.04 2.03 0.00 1.68 0.00 0.00 1.91 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.41 7.81 96 L 7.25 4.15 0.00 1.87 1.78 1.13 0.61 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 97 K 7.93 4.15 0.00 1.89 1.78 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.40 7.81 98 P 0.00 4.14 0.00 2.05 2.06 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 99 L 7.62 3.71 0.00 1.46 1.70 -0.06 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.75 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 0.00 0.00 0.00 101 F 10.13 5.28 0.00 3.10 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 0.00 102 L 7.51 4.67 0.00 1.61 1.58 0.95 0.95 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 0.00 103 T 8.29 4.29 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 0.00 104 R 9.15 3.87 0.00 1.81 2.02 0.00 3.52 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 105 D 8.21 4.23 0.00 2.83 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 0.00 106 A 7.89 4.23 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 0.00 107 R 7.63 4.11 0.00 1.86 1.90 0.00 3.12 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 108 V 7.97 4.38 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 0.75 0.00 0.00 0.93 0.00 0.00 109 V 8.50 3.56 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.62 4.17 0.00 2.12 1.94 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 2.28 2.30 0.00 111 R 7.79 3.80 0.00 1.78 1.87 0.00 3.15 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 112 K 8.30 4.55 0.00 1.73 1.64 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.44 7.81 113 K 8.36 4.53 0.00 1.85 2.01 0.00 1.69 0.00 0.00 2.03 0.00 0.00 3.17 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.45 1.50 7.81 114 Y 9.10 4.60 0.00 3.07 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 0.00 115 G 8.94 4.43 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 0.00 116 K 7.51 4.47 0.00 1.69 1.75 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.57 7.81 117 H 7.72 3.87 0.00 3.47 3.66 0.00 5.64 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.14 4.48 0.00 1.73 1.69 0.00 1.80 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 1.36 1.40 7.81 119 A 8.40 4.40 1.42 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 0.00 120 R 9.48 4.32 0.00 1.77 1.92 0.00 3.21 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 121 R 8.19 3.85 0.00 1.78 1.97 0.00 3.43 0.00 0.00 3.29 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 122 A 8.21 4.29 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 0.00 123 P 0.00 4.56 0.00 2.22 2.04 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 1.96 1.93 0.00 124 Q 8.70 3.92 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 125 Y 8.63 4.31 0.00 2.89 2.78 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 0.00 126 S 8.44 4.21 0.00 4.04 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 0.00 127 K 8.39 4.44 0.00 1.58 1.73 0.00 1.30 0.00 0.00 1.49 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.22 1.39 7.81 128 R 8.19 4.16 0.00 1.89 1.86 0.00 3.10 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.56 0.00