NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.9016 8.3881 118.1522 55.4669 33.5813 173.4408 2 I 4.8761 8.6409 111.8116 58.8819 41.4706 172.6536 3 I 5.0194 8.7759 124.4478 59.8344 40.2618 176.0760 4 V 4.9259 8.9216 125.6743 61.3236 34.5840 173.3448 5 Y 5.4089 9.2016 129.4113 56.3507 41.1048 174.2310 6 T 5.1426 8.4222 119.6710 60.2190 71.7261 172.0172 7 T 4.8308 7.8200 113.2688 59.7441 72.0262 173.0672 8 F 4.6031 8.7872 120.8985 54.8822 42.8592 174.5569 9 P 4.5469 0.0000 0.0000 65.5616 31.9950 175.2288 10 D 4.3361 7.1617 115.9320 52.6067 44.7746 175.2806 11 W 3.9966 8.6586 117.2772 59.6864 28.9791 178.0996 12 E 3.9456 8.2220 119.2185 59.2488 29.2062 178.8787 13 S 3.9373 7.9137 113.5940 61.2543 63.1086 175.9808 14 A 2.0000 7.3582 124.4036 54.2530 17.9676 179.5506 15 E 3.8474 8.3454 117.4391 59.1608 29.5083 179.4616 16 K 3.8262 7.9830 119.7506 59.4767 32.2953 179.0778 17 V 3.4954 7.5518 118.4329 65.9910 31.3925 178.1721 18 V 3.6061 7.6668 118.0532 65.9595 31.2632 178.1804 19 K 3.9845 8.3742 118.6482 59.6576 31.8734 179.4706 20 T 3.8501 8.0356 116.1171 66.6642 68.3392 176.7139 21 L 4.0443 8.0880 120.8894 57.5752 41.5535 179.5720 22 L 3.9805 8.2049 119.2302 57.8336 41.3903 179.6427 23 K 3.9500 8.0976 117.3760 59.3046 32.0793 178.3762 24 E 4.2323 8.1168 115.7816 55.7536 29.8281 176.7190 25 R 3.9254 7.9567 117.7931 57.3176 28.1591 177.9661 26 L 4.2604 8.0156 119.1427 55.6562 42.2933 177.1248 27 I 4.6917 7.3472 109.9378 58.8920 40.5738 174.7661 28 A 4.2763 8.6107 123.7454 54.2433 19.6332 177.0613 29 C 4.9320 7.7023 107.2928 57.8043 32.6613 172.9725 30 A 5.3926 8.7316 120.5358 50.3507 22.1279 175.0771 31 N 5.0821 9.4272 118.6529 51.4752 41.5407 173.5380 32 L 5.4222 8.7242 123.7907 52.9709 44.4011 176.1186 33 R 4.9404 8.6673 118.3851 54.7238 33.0621 174.4755 34 E 4.6176 9.0094 121.0891 57.3640 30.5364 175.4504 35 H 4.9917 8.8871 116.8324 54.9173 32.8868 171.9632 36 R 5.0063 8.7136 117.4068 54.5061 31.8710 175.6869 37 A 4.9107 8.9056 126.3073 50.4075 21.5841 175.5746 38 F 5.1699 8.6499 119.3720 55.9173 42.5417 173.8384 39 Y 4.7362 8.0246 120.0224 56.2113 41.8660 172.8921 40 W 5.1257 9.0094 119.6360 55.6132 30.6360 176.4180 41 W 5.0369 9.3519 133.8943 56.5500 32.7859 174.9239 42 E 3.2730 9.7547 127.6204 57.4879 26.1428 175.6946 43 G 3.9430 8.3445 102.5126 45.5353 0.0000 173.0224 44 K 4.8532 8.2338 118.4779 54.2123 35.5804 175.2914 45 I 3.9190 8.0955 123.0156 60.8683 37.7705 174.8366 46 E 4.5263 9.0226 128.7160 54.2571 31.9391 174.0835 47 E 4.6472 8.3008 125.7994 54.3511 32.5680 174.4060 48 D 4.6951 8.3651 123.7655 52.5275 45.1926 174.2361 49 K 4.6726 8.6300 125.2080 56.3841 33.1545 175.9145 50 E 4.8148 9.1098 123.1160 54.7238 34.9766 174.2642 51 V 4.2880 8.6410 120.7479 61.0650 33.6362 175.0027 52 G 4.2601 8.8630 115.7830 45.6619 0.0000 172.0569 53 A 5.3324 8.6788 123.6041 50.0285 22.4467 175.0263 54 I 4.7142 9.0554 124.6248 60.0670 38.9844 174.8776 55 L 5.3272 9.2224 128.0117 52.9131 44.6529 175.8226 56 K 5.1249 8.7751 121.4426 55.2231 35.4844 175.4634 57 T 4.9550 8.5650 118.3653 61.4950 71.6009 172.5374 58 R 4.5462 8.5153 120.2532 55.4776 30.9624 177.4969 59 E 4.0454 9.0075 121.0102 59.8631 29.3055 179.4520 60 D 4.6131 8.1121 116.3440 55.3593 39.8191 177.1974 61 L 4.4277 7.8066 119.5528 54.5019 41.9272 177.8510 62 W 4.5548 8.1892 130.2753 60.9659 30.6872 177.6691 63 E 3.3982 8.0889 117.7231 59.0931 28.9699 178.8323 64 E 3.8422 7.9686 118.9304 59.0629 29.6898 178.5038 65 L 3.8986 8.1189 120.7475 57.8888 42.1842 178.7343 66 K 3.5325 7.7940 120.0109 59.3317 31.9734 178.3304 67 E 3.8143 7.9301 119.4346 59.3578 29.5410 179.0257 68 R 3.9279 7.9588 118.0897 59.2407 30.2051 179.1194 69 I 3.7537 8.0625 120.0092 64.2607 36.8603 178.4897 70 K 3.9373 7.8798 118.3431 59.7078 31.9921 178.9898 71 E 4.1282 8.1082 117.2615 58.2999 29.4844 178.2260 72 L 4.4896 7.5405 116.8564 54.0501 43.0155 176.1691 73 H 4.4389 7.5768 119.3689 54.7714 30.3820 173.6340 74 P 4.4033 0.0000 0.0000 65.1261 31.5656 176.0689 75 Y 4.8213 7.8039 116.7746 56.9582 38.9482 175.0229 76 D 4.5382 9.0194 124.3263 56.9758 41.1169 177.2132 77 V 4.2711 7.3043 118.4287 60.0175 31.3186 172.7885 78 P 4.4260 0.0000 0.0000 61.4367 32.6913 176.2954 79 A 4.3267 8.1902 121.3520 51.5378 19.9727 176.4826 80 I 4.7127 8.4864 123.1741 59.5526 39.6311 174.1158 81 I 4.4896 8.8410 127.9573 59.3212 39.6133 174.6008 82 R 4.5880 8.3277 128.1127 54.8804 31.1080 175.2699 83 I 4.4620 8.4550 127.3525 59.3090 40.0479 174.9346 84 D 4.6411 8.6853 127.2038 54.2488 41.7496 175.9638 85 V 4.0824 8.0457 122.8467 61.8714 31.6399 175.9550 86 D 4.4886 8.9141 128.4514 57.1007 41.2030 175.8184 87 D 4.6130 7.6562 114.9329 53.6769 43.8282 174.4705 88 V 4.5578 7.9548 121.7899 58.7877 34.4182 174.3823 89 N 4.4576 8.6784 119.9049 53.0873 38.6653 175.6466 90 E 4.0051 8.9279 124.6222 59.4577 29.8968 178.6718 91 D 4.4174 8.1866 118.7608 56.6872 39.2741 177.9564 92 Y 4.0329 8.0328 120.3991 60.3305 38.9476 177.2366 93 L 4.0026 8.0899 121.2733 58.1164 42.1187 178.8540 94 K 3.9181 8.4911 119.8965 59.1767 32.1439 178.5470 95 W 4.1678 8.1180 128.4700 60.4227 30.4193 177.6625 96 L 3.2891 7.8548 119.2919 57.9907 41.6282 178.7046 97 I 3.7667 7.8018 119.7791 64.3907 36.8073 178.2287 98 E 3.8947 7.9673 118.4524 59.0779 29.3772 178.4519 99 E 4.0686 7.4784 115.8600 56.0008 29.9934 176.0538 100 T 4.8151 6.4820 109.4069 59.1122 71.4317 174.5988 101 K 4.2028 8.6115 122.2869 57.0051 33.6064 177.1540 102 K 4.2511 8.3033 119.8043 56.6761 32.4723 176.1170 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 8.39 4.90 0.00 2.19 2.49 0.00 0.00 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 2 I 8.64 4.88 1.79 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.95 0.92 0.00 0.00 3 I 8.78 5.02 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.07 1.02 0.00 0.00 4 V 8.92 4.93 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 1.18 0.00 0.00 1.17 0.00 0.00 5 Y 9.20 5.41 0.00 3.03 2.80 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 6 T 8.42 5.14 4.11 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 0.00 0.00 0.00 0.91 0.00 0.00 7 T 7.82 4.83 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 1.00 0.00 0.00 8 F 8.79 4.60 0.00 2.76 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 9 P 0.00 4.55 0.00 2.22 2.37 0.00 3.61 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.83 0.00 10 D 7.16 4.34 0.00 2.85 2.56 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 11 W 8.66 4.00 0.00 3.43 3.20 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 0.00 12 E 8.22 3.95 0.00 2.10 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 2.37 2.40 0.00 13 S 7.91 3.94 0.00 3.96 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 14 A 7.36 2.00 0.93 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 0.00 0.00 15 E 8.35 3.85 0.00 2.08 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 2.45 2.69 0.00 16 K 7.98 3.83 0.00 1.84 1.82 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.40 7.81 17 V 7.55 3.50 1.75 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 1.05 0.00 0.00 0.94 0.00 0.00 18 V 7.67 3.61 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 1.08 0.00 0.00 0.95 0.00 0.00 19 K 8.37 3.98 0.00 1.84 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.63 7.81 20 T 8.04 3.85 4.38 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 1.20 0.00 0.00 21 L 8.09 4.04 0.00 1.87 1.73 0.99 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.20 3.98 0.00 1.84 1.72 0.96 1.34 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 23 K 8.10 3.95 0.00 1.84 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 24 E 8.12 4.23 0.00 2.01 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 0.00 2.31 2.45 0.00 25 R 7.96 3.93 0.00 1.96 2.03 0.00 3.24 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 26 L 8.02 4.26 0.00 1.64 1.72 0.96 0.57 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 27 I 7.35 4.69 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.69 0.97 0.00 0.00 28 A 8.61 4.28 0.94 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 29 C 7.70 4.93 0.00 3.19 3.41 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 0.00 0.00 0.00 0.00 30 A 8.73 5.39 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 31 N 9.43 5.08 0.00 2.72 2.80 0.00 0.00 6.74 6.39 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 32 L 8.72 5.42 0.00 1.73 1.40 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.67 4.94 0.00 1.96 2.10 0.00 3.05 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 34 E 9.01 4.62 0.00 2.01 2.00 0.00 0.00 0.00 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 2.68 0.00 35 H 8.89 4.99 0.00 3.22 3.45 0.00 5.23 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.71 5.01 0.00 1.87 1.93 0.00 3.28 0.00 0.00 3.45 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 37 A 8.91 4.91 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 38 F 8.65 5.17 0.00 2.82 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 39 Y 8.02 4.74 0.00 3.07 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 40 W 9.01 5.13 0.00 3.35 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 41 W 9.35 5.04 0.00 3.47 3.18 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 42 E 9.75 3.27 0.00 1.16 1.35 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 1.77 1.47 0.00 43 G 8.34 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 44 K 8.23 4.85 0.00 2.13 1.77 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.42 7.81 45 I 8.10 3.92 1.61 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 -0.36 0.71 0.00 0.00 46 E 9.02 4.53 0.00 1.91 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 0.00 0.00 0.00 1.61 1.94 0.00 47 E 8.30 4.65 0.00 1.47 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 1.75 1.47 0.00 48 D 8.37 4.70 0.00 2.82 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 49 K 8.63 4.67 0.00 1.67 1.73 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 50 E 9.11 4.81 0.00 1.62 1.80 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 2.31 2.45 0.00 51 V 8.64 4.29 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 -0.31 0.00 0.00 52 G 8.86 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 53 A 8.68 5.33 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 54 I 9.06 4.71 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.04 1.01 0.00 0.00 55 L 9.22 5.33 0.00 1.66 1.65 1.03 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 56 K 8.78 5.12 0.00 1.90 1.90 0.00 2.02 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.49 7.81 57 T 8.56 4.95 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 1.33 0.00 0.00 58 R 8.52 4.55 0.00 1.94 1.93 0.00 3.19 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 59 E 9.01 4.05 0.00 2.08 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 2.41 2.44 0.00 60 D 8.11 4.61 0.00 2.86 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 61 L 7.81 4.43 0.00 1.95 1.76 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 62 W 8.19 4.55 0.00 3.40 3.22 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 63 E 8.09 3.40 0.00 1.94 1.84 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 2.44 2.31 0.00 64 E 7.97 3.84 0.00 1.99 2.03 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 2.34 2.32 0.00 65 L 8.12 3.90 0.00 1.85 1.88 0.96 0.88 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 66 K 7.79 3.53 0.00 0.79 1.12 0.00 1.57 0.00 0.00 0.86 0.00 0.00 2.66 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.12 1.08 7.81 67 E 7.93 3.81 0.00 2.01 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 2.24 2.41 0.00 68 R 7.96 3.93 0.00 1.96 1.94 0.00 3.48 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 69 I 8.06 3.75 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.13 0.95 0.00 0.00 70 K 7.88 3.94 0.00 1.87 1.85 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.54 7.81 71 E 8.11 4.13 0.00 2.09 2.00 0.00 0.00 0.00 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 2.50 0.00 72 L 7.54 4.49 0.00 1.65 1.71 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 73 H 7.58 4.44 0.00 3.40 3.17 0.00 5.76 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.40 0.00 2.12 2.13 0.00 3.50 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 75 Y 7.80 4.82 0.00 2.78 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 D 9.02 4.54 0.00 2.67 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 77 V 7.30 4.27 2.02 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 0.83 0.00 0.00 0.92 0.00 0.00 78 P 0.00 4.43 0.00 1.87 1.33 0.00 3.76 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 1.88 1.83 0.00 79 A 8.19 4.33 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 80 I 8.49 4.71 1.97 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 1.04 0.00 0.00 81 I 8.84 4.49 2.18 0.00 0.00 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 1.19 0.87 0.95 0.00 0.00 82 R 8.33 4.59 0.00 0.67 0.82 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.11 0.00 83 I 8.46 4.46 1.83 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 1.17 0.60 0.86 0.00 0.00 84 D 8.69 4.64 0.00 2.49 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 85 V 8.05 4.08 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 0.81 0.00 0.00 0.96 0.00 0.00 86 D 8.91 4.49 0.00 2.68 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 87 D 7.66 4.61 0.00 2.56 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 88 V 7.95 4.56 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 0.86 0.00 0.00 1.07 0.00 0.00 89 N 8.68 4.46 0.00 3.12 3.02 0.00 0.00 5.68 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 90 E 8.93 4.01 0.00 2.14 2.03 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 2.41 2.48 0.00 91 D 8.19 4.42 0.00 2.96 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 92 Y 8.03 4.03 0.00 3.15 3.31 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 93 L 8.09 4.00 0.00 1.95 1.89 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.49 3.92 0.00 2.00 2.00 0.00 1.58 0.00 0.00 1.59 0.00 0.00 3.16 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.67 7.81 95 W 8.12 4.17 0.00 3.40 3.17 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 96 L 7.85 3.29 0.00 1.39 1.79 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.80 3.77 1.95 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 1.49 1.30 0.87 0.00 0.00 98 E 7.97 3.89 0.00 1.91 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 2.30 2.43 0.00 99 E 7.48 4.07 0.00 1.16 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 1.47 1.47 0.00 100 T 6.48 4.82 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 1.10 0.00 0.00 101 K 8.61 4.20 0.00 1.75 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.40 7.81 102 K 8.30 4.25 0.00 1.58 1.67 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.52 7.81