NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3167 8.2931 118.1930 54.7033 32.3593 173.0791 2 G 3.7988 8.3946 112.1378 45.0311 0.0000 172.5037 3 A 4.0146 8.1415 133.4574 51.0314 19.2779 176.3674 4 R 4.0394 8.2588 121.4766 57.2138 31.1860 176.0372 5 A 4.5660 8.1641 123.5154 52.3833 18.6057 177.9648 6 S 4.6572 7.8065 114.5053 58.7136 65.2864 175.0000 7 V 3.9983 7.5760 113.8050 61.0320 31.8851 172.4398 8 L 3.5175 8.0830 126.7049 54.8604 41.0604 173.3061 9 S 4.8777 8.6094 117.7750 58.9907 70.0800 175.3811 10 G 3.8227 8.4603 104.9252 45.4267 0.0000 175.0238 11 G 3.6209 9.3507 109.8262 47.5923 0.0000 174.5332 12 E 3.9368 8.1319 120.3843 59.4292 29.6485 179.1559 13 L 4.1399 7.9331 119.4758 58.0011 42.0813 178.3434 14 D 4.3946 8.0198 118.2741 57.5179 40.7963 178.4953 15 R 4.0683 8.0984 118.4407 58.7248 29.7939 178.8024 16 W 4.3269 8.1005 127.8707 60.2072 30.7158 177.2969 17 E 4.1308 8.2124 118.8522 58.7764 29.2216 178.0146 18 K 3.9623 7.9395 118.9989 58.3089 32.7081 176.6389 19 I 4.9407 6.9719 119.0429 59.7661 38.9113 175.2864 20 R 4.6049 8.4100 124.9586 54.1580 33.1904 174.8626 21 L 4.5442 7.6229 122.1006 52.7035 42.6092 177.5591 22 R 4.8068 7.8773 126.3073 54.8408 29.9082 173.5352 23 P 4.3534 0.0000 0.0000 64.7506 32.1726 179.0493 24 G 4.2263 7.5304 107.6256 43.8879 0.0000 172.8775 25 G 3.7694 7.7211 112.2070 44.0759 0.0000 176.3871 26 K 4.3715 8.3376 121.4680 55.0764 33.9197 174.7452 27 K 4.6985 8.2404 122.3954 54.9197 37.4919 174.6028 28 K 4.4737 8.2305 119.3660 54.7279 36.2210 177.3302 29 Y 4.0147 7.6249 118.8935 57.3369 35.8022 176.1966 30 K 4.5611 8.0378 123.0854 55.2050 34.8888 177.3702 31 L 4.3056 8.5871 119.4499 58.2857 41.8861 178.8755 32 K 4.0580 8.2804 119.3864 59.5715 32.0204 178.3625 33 H 4.4049 8.2414 115.3306 59.1250 28.8808 177.5999 34 I 3.7136 8.2062 119.7912 63.9091 37.6917 177.9433 35 V 3.6334 7.9100 119.2851 65.4875 31.3763 177.5979 36 W 4.1902 8.4156 127.9730 60.7430 30.6772 177.9443 37 A 3.3805 8.3925 120.4904 54.5020 17.7353 179.5886 38 S 3.8671 7.9831 112.1343 61.5378 62.5551 176.3623 39 R 3.8130 7.8970 121.2039 59.3889 29.9201 178.3302 40 E 3.7647 7.8179 118.2626 59.4227 29.4852 179.2194 41 L 3.5747 7.2537 120.2096 57.7981 42.0516 178.6160 42 E 3.9097 8.0652 119.5713 59.2218 29.3794 178.8080 43 R 4.0352 7.8926 117.6987 59.0613 30.1434 178.3650 44 F 4.1822 8.1872 117.1904 60.3545 39.1127 177.2074 45 A 4.0639 8.1577 119.1289 55.2014 18.8869 179.7265 46 V 3.3064 7.5845 107.9498 62.0331 29.6129 174.0863 47 N 4.3870 7.6023 126.4864 53.8767 41.8608 175.9689 48 P 4.2604 0.0000 0.0000 63.6668 31.9345 176.4593 49 G 3.9696 7.7104 103.9134 46.0893 0.0000 175.2953 50 L 4.1193 7.8916 120.9800 57.2232 40.7599 178.8828 51 L 3.7551 7.7791 119.5588 58.6105 40.7281 178.1723 52 E 3.9231 8.0760 119.4601 58.5451 29.7494 176.4787 53 T 4.4812 6.8907 107.2403 60.1567 70.9447 175.8051 54 S 3.9741 8.2190 119.1001 61.2288 62.9832 176.7025 55 E 4.0934 8.1184 121.3769 59.3813 29.2568 179.4008 56 G 3.7107 7.6463 105.8354 47.7336 0.0000 175.5965 57 C 4.1605 7.8683 118.9283 62.7921 28.1421 175.9049 58 R 4.0503 7.7929 118.9001 59.6679 29.4477 178.1699 59 Q 3.9601 8.0223 119.5408 59.2268 29.2074 178.2288 60 I 3.8903 7.6721 113.6388 63.8417 37.8460 178.0126 61 L 4.3401 8.2355 121.1077 57.5403 41.2338 179.5405 62 G 3.6855 7.9888 104.8416 47.9732 0.0000 175.3299 63 Q 4.1717 8.0507 120.7912 58.4599 29.3483 177.6461 64 L 4.2489 8.1741 120.0683 56.8545 41.7971 178.5768 65 Q 3.7343 8.1346 120.5042 58.9715 28.7390 177.4460 66 P 4.3114 0.0000 0.0000 65.7528 31.6097 177.9682 67 S 4.3149 7.9987 113.8165 60.1138 62.5410 176.1030 68 L 4.0820 7.4375 121.4254 56.8013 41.3233 177.4801 69 Q 4.4093 7.4101 115.4447 56.1511 28.7593 175.9691 70 T 4.4462 7.5510 112.9436 62.9890 69.9122 174.9957 71 G 4.2614 7.6965 109.0707 42.5489 0.0000 174.5103 72 S 4.1691 8.1761 116.3327 61.8343 62.8123 175.4228 73 E 3.8850 8.3198 121.7721 59.5107 29.2442 178.1693 74 E 4.2211 7.9878 117.9540 59.0403 30.2274 178.4816 75 L 4.0726 7.9462 119.1646 58.3304 41.8208 179.6780 76 R 4.0417 8.0298 118.0285 59.4161 29.8701 178.8692 77 S 4.2270 7.7166 115.3902 61.8008 62.9728 176.5260 78 L 4.1583 8.6362 121.6406 58.0657 41.2812 179.1122 79 Y 3.9653 8.3781 119.9635 60.4549 38.7605 177.3517 80 N 4.6226 8.5572 118.1542 55.8983 37.5616 177.6312 81 T 4.3202 8.3636 118.5379 66.7131 68.8552 177.2479 82 V 3.6746 7.9673 120.8406 64.7591 31.2249 178.2856 83 A 3.9966 8.0945 121.3129 55.3868 18.3064 179.6143 84 T 3.8888 8.0482 114.3129 66.9764 68.4566 176.8219 85 L 4.0313 8.2398 120.8918 57.6235 41.6120 178.6096 86 Y 3.8517 8.0591 119.6922 61.0274 38.6766 178.3224 87 C 4.2529 8.2852 117.4125 62.9389 28.1141 176.1806 88 V 3.6303 7.5657 118.2773 65.5067 31.0258 176.5835 89 H 4.8333 7.8049 113.0330 55.5742 29.9282 175.0891 90 Q 4.4857 7.9256 117.9808 57.3604 30.3097 175.5684 91 R 4.3127 8.1310 113.9564 56.9683 32.3701 177.0261 92 I 3.4301 8.2258 116.4927 60.8059 38.0103 172.9502 93 E 4.3857 7.6279 119.3891 56.4171 29.3926 175.8701 94 I 4.2192 7.5423 118.5872 59.9293 39.4548 174.5700 95 K 4.3990 8.6426 126.5176 57.5504 33.5755 175.6590 96 D 5.1951 7.4607 116.2794 52.0015 46.5535 176.2901 97 T 4.0504 8.3566 116.9615 66.5007 68.3857 177.2990 98 K 3.9302 8.0237 121.3914 59.5330 32.2508 178.1857 99 E 4.1193 8.1680 118.6315 58.5285 29.6396 178.3929 100 A 3.9955 7.5958 121.0311 55.2857 18.5504 179.6689 101 L 4.0904 7.9317 117.0324 57.5798 41.6183 179.4892 102 D 4.3155 7.6546 117.9127 57.3274 40.7497 178.7533 103 K 3.9502 8.0875 118.8164 59.5978 32.1929 179.3633 104 I 3.4201 7.7641 118.8610 63.8795 37.8129 177.5415 105 E 3.9916 8.1654 120.1994 58.8273 29.1936 178.3356 106 E 3.9701 7.8605 119.0832 58.7137 29.7894 178.1607 107 E 4.0716 7.8631 119.5002 59.2310 29.9753 178.6651 108 Q 4.0659 7.7181 117.7510 59.0649 28.5597 178.1658 109 N 4.5569 8.1167 116.9325 55.3873 39.0297 175.8294 110 K 4.3486 7.6109 118.7186 57.4762 31.9891 178.2693 111 S 4.2558 7.7788 114.1015 60.6811 62.2909 175.2363 112 K 4.0636 7.4768 120.3855 58.8487 32.4709 177.8468 113 K 4.3641 7.6093 121.6357 54.8427 30.8338 176.5686 114 K 4.3242 7.5602 120.8907 56.7053 32.9363 177.8068 115 A 4.5727 7.7920 117.4475 52.8525 19.7630 176.7102 116 Q 4.8151 7.7141 117.5294 55.1124 31.5831 174.5748 117 Q 4.2109 8.6168 114.2336 56.9490 29.7786 175.0997 118 A 4.3980 7.8945 120.7315 50.3279 18.8015 174.9301 119 A 4.7058 7.7143 123.8013 51.4830 22.0293 176.5407 120 A 4.1572 8.2037 120.4631 53.3553 19.0834 176.4193 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 8.29 4.32 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 2 G 8.39 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 3 A 8.14 4.01 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 4 R 8.26 4.04 0.00 1.75 1.81 0.00 3.19 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 5 A 8.16 4.57 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 6 S 7.81 4.66 0.00 3.89 3.91 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 7 V 7.58 4.00 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 0.63 0.00 0.00 0.87 0.00 0.00 8 L 8.08 3.52 0.00 1.47 1.50 0.51 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.61 4.88 0.00 3.79 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 10 G 8.46 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 0.00 0.00 0.00 11 G 9.35 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 0.00 0.00 0.00 12 E 8.13 3.94 0.00 1.95 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 2.38 2.41 0.00 13 L 7.93 4.14 0.00 1.81 1.74 0.97 1.31 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 14 D 8.02 4.39 0.00 3.06 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 15 R 8.10 4.07 0.00 2.15 2.02 0.00 3.21 0.00 0.00 3.12 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 16 W 8.10 4.33 0.00 3.29 3.29 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 17 E 8.21 4.13 0.00 2.10 2.13 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 2.34 2.34 0.00 18 K 7.94 3.96 0.00 1.95 1.94 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.50 7.81 19 I 6.97 4.94 1.68 0.00 0.00 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 1.32 1.97 0.99 0.00 0.00 20 R 8.41 4.60 0.00 1.85 1.70 0.00 3.07 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 21 L 7.62 4.54 0.00 1.32 1.25 0.24 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.88 4.81 0.00 1.64 1.76 0.00 3.37 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 23 P 0.00 4.35 0.00 2.18 2.06 0.00 3.81 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 1.91 1.88 0.00 24 G 7.53 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 0.00 0.00 0.00 0.00 25 G 7.72 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 0.00 0.00 0.00 26 K 8.34 4.37 0.00 1.66 1.68 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.42 7.81 27 K 8.24 4.70 0.00 1.32 1.58 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.49 7.81 28 K 8.23 4.47 0.00 1.54 1.62 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.68 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.25 1.37 7.81 29 Y 7.62 4.01 0.00 2.72 1.46 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 0.00 30 K 8.04 4.56 0.00 1.97 1.91 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.49 7.81 31 L 8.59 4.31 0.00 1.85 1.74 0.91 0.24 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 32 K 8.28 4.06 0.00 1.91 1.80 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.57 7.81 33 H 8.24 4.40 0.00 4.21 4.00 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 34 I 8.21 3.71 1.25 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.13 0.85 0.00 0.00 35 V 7.91 3.63 2.32 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 1.07 0.00 0.00 1.01 0.00 0.00 36 W 8.42 4.19 0.00 3.53 3.55 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 37 A 8.39 3.38 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 38 S 7.98 3.87 0.00 3.91 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 39 R 7.90 3.81 0.00 1.97 1.87 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 40 E 7.82 3.76 0.00 1.37 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 2.16 2.01 0.00 41 L 7.25 3.57 0.00 1.46 1.47 0.80 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.07 3.91 0.00 2.11 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 2.29 2.28 0.00 43 R 7.89 4.04 0.00 2.07 2.23 0.00 3.36 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 44 F 8.19 4.18 0.00 3.08 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 45 A 8.16 4.06 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 46 V 7.58 3.31 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 0.72 0.00 0.00 1.00 0.00 0.00 47 N 7.60 4.39 0.00 2.97 2.79 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 48 P 0.00 4.26 0.00 2.17 2.19 0.00 3.90 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 2.00 1.97 0.00 49 G 7.71 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 0.00 0.00 0.00 50 L 7.89 4.12 0.00 1.92 1.96 0.89 0.26 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 51 L 7.78 3.76 0.00 1.67 1.78 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.08 3.92 0.00 1.92 1.93 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 2.24 2.16 0.00 53 T 6.89 4.48 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 1.15 0.00 0.00 54 S 8.22 3.97 0.00 3.61 3.35 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 0.00 55 E 8.12 4.09 0.00 1.97 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 2.41 2.36 0.00 56 G 7.65 3.71 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 0.00 57 C 7.87 4.16 0.00 3.19 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 58 R 7.79 4.05 0.00 2.05 2.17 0.00 3.30 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 59 Q 8.02 3.96 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 60 I 7.67 3.89 1.95 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 1.66 0.69 0.96 0.00 0.00 61 L 8.24 4.34 0.00 1.74 1.54 0.85 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.99 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 63 Q 8.05 4.17 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 64 L 8.17 4.25 0.00 2.34 1.91 1.02 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.13 3.73 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 66 P 0.00 4.31 0.00 2.30 2.29 0.00 3.76 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 2.18 2.06 0.00 67 S 8.00 4.31 0.00 4.09 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 68 L 7.44 4.08 0.00 1.68 1.60 0.20 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 7.41 4.41 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.29 0.00 70 T 7.55 4.45 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 1.24 0.00 0.00 71 G 7.70 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 0.00 0.00 0.00 0.00 72 S 8.18 4.17 0.00 3.87 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 73 E 8.32 3.88 0.00 2.04 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 2.37 2.37 0.00 74 E 7.99 4.22 0.00 2.20 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 0.00 2.80 2.71 0.00 75 L 7.95 4.07 0.00 1.88 1.74 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.03 4.04 0.00 1.99 2.01 0.00 3.11 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 77 S 7.72 4.23 0.00 4.46 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 78 L 8.64 4.16 0.00 2.01 1.69 1.06 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.38 3.97 0.00 3.38 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 80 N 8.56 4.62 0.00 3.21 3.20 0.00 0.00 7.04 7.23 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 81 T 8.36 4.32 4.53 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 1.54 0.00 0.00 82 V 7.97 3.67 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 0.80 0.00 0.00 0.92 0.00 0.00 83 A 8.09 4.00 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 84 T 8.05 3.89 4.36 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 0.73 0.00 0.00 85 L 8.24 4.03 0.00 2.03 1.74 0.65 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 8.06 3.85 0.00 3.20 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 87 C 8.29 4.25 0.00 3.18 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 88 V 7.57 3.63 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 0.73 0.00 0.00 1.02 0.00 0.00 89 H 7.80 4.83 0.00 3.00 3.16 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.93 4.49 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 91 R 8.13 4.31 0.00 1.81 1.93 0.00 3.24 0.00 0.00 3.18 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 92 I 8.23 3.43 1.88 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 1.35 0.88 0.92 0.00 0.00 93 E 7.63 4.39 0.00 1.97 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 2.25 2.29 0.00 94 I 7.54 4.22 1.89 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 1.40 1.06 0.92 0.00 0.00 95 K 8.64 4.40 0.00 1.84 1.81 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 96 D 7.46 5.20 0.00 2.69 2.48 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 0.00 0.00 0.00 0.00 97 T 8.36 4.05 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 98 K 8.02 3.93 0.00 1.80 1.80 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.49 7.81 99 E 8.17 4.12 0.00 2.08 1.93 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 2.38 2.37 0.00 100 A 7.60 4.00 1.44 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 0.00 101 L 7.93 4.09 0.00 1.80 1.83 1.03 1.15 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 0.00 102 D 7.65 4.32 0.00 2.89 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 0.00 103 K 8.09 3.95 0.00 1.99 1.86 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.45 7.81 104 I 7.76 3.42 1.94 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 0.50 1.28 0.86 0.00 0.00 105 E 8.17 3.99 0.00 2.26 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 2.31 2.34 0.00 106 E 7.86 3.97 0.00 2.14 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 2.32 2.31 0.00 107 E 7.86 4.07 0.00 2.02 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 0.00 2.39 2.42 0.00 108 Q 7.72 4.07 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 109 N 8.12 4.56 0.00 2.86 2.82 0.00 0.00 7.34 6.92 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 0.00 110 K 7.61 4.35 0.00 2.09 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.48 7.81 111 S 7.78 4.26 0.00 4.06 3.91 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 0.00 112 K 7.48 4.06 0.00 1.63 1.86 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.38 7.81 113 K 7.61 4.36 0.00 1.73 1.74 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.40 7.81 114 K 7.56 4.32 0.00 1.91 2.00 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.43 7.81 115 A 7.79 4.57 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 0.00 116 Q 7.71 4.82 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 117 Q 8.62 4.21 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 118 A 7.89 4.40 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 0.00 119 A 7.71 4.71 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 0.00 120 A 8.20 4.16 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