NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1676 8.3049 120.3296 54.7357 33.1214 179.3876 2 L 3.1243 8.2433 125.5414 54.9023 38.5461 172.4419 3 Q 4.1741 7.9682 119.6431 54.3274 31.1678 171.5436 4 P 4.1151 0.0000 0.0000 62.8899 31.5452 175.8684 5 K 3.8676 8.7787 124.7362 59.0585 32.0453 175.8404 6 R 4.7151 7.2587 111.3308 55.5637 32.5263 173.7826 7 T 4.4253 7.8304 110.9018 62.8646 72.0927 174.7078 8 K 4.1188 8.7737 123.7707 57.2356 32.1365 177.0321 9 F 4.7342 7.8263 118.6062 56.0095 42.5031 174.5404 10 R 4.1958 9.1235 125.4888 58.6686 30.1495 177.1985 11 K 4.5364 7.8035 114.4618 54.7576 35.3518 175.8123 12 M 4.4143 8.1381 121.6449 53.9744 33.5440 174.9676 13 H 4.4787 7.9444 117.4310 55.5017 29.4060 176.3799 14 K 4.7777 8.5366 134.1021 56.2141 33.9742 176.7353 15 G 3.7233 7.9862 107.7768 47.4448 0.0000 172.0209 16 R 4.5096 7.8822 116.8758 55.7127 30.9255 174.2183 17 N 4.5926 8.6335 118.0673 54.2100 39.6517 175.7110 18 R 4.5180 8.2960 116.8397 55.1316 31.5799 174.2921 19 G 3.8166 8.5401 109.9105 45.7715 0.0000 170.0991 20 L 3.4386 8.4692 122.9711 54.2284 37.6456 174.5633 21 A 4.3909 8.2111 125.8246 51.7753 19.3700 177.2445 22 Q 4.5095 8.5401 116.7603 56.6136 31.3186 177.3432 23 G 3.8882 7.6911 108.3216 44.6563 0.0000 173.3782 24 T 4.2024 7.1684 119.7290 65.7656 69.7129 175.8605 25 D 4.4349 7.6850 123.0073 54.6376 41.7684 177.2440 26 V 4.1706 7.9331 120.7295 62.2685 30.1106 175.4442 27 S 4.3781 8.4535 120.6242 58.5102 62.8723 174.4142 28 F 4.1329 7.7955 117.0871 57.8579 41.1703 176.2946 29 G 4.5106 9.8098 110.0978 44.7583 0.0000 173.0791 30 S 4.4871 8.5681 111.9520 58.5326 63.8707 174.3746 31 F 5.0938 8.2142 119.0258 56.1769 43.2641 174.0047 32 G 5.0412 8.9171 109.2671 44.8679 0.0000 170.5652 33 L 5.0995 8.4452 120.9994 52.8803 43.6412 175.9327 34 K 4.1195 9.2116 128.3912 56.6544 33.4037 175.8026 35 A 4.0513 8.5887 125.5605 48.9452 18.0417 176.3692 36 V 3.2548 8.3054 116.3626 59.8830 29.5204 170.8083 37 G 4.3412 7.2238 107.2605 42.9508 0.0000 170.1411 38 R 4.6150 8.1566 119.0294 53.9254 33.8253 173.9770 39 G 3.8419 7.0606 102.4384 44.0595 0.0000 172.5467 40 R 4.8578 8.3870 115.7126 54.3343 32.6010 174.9440 41 L 4.9626 8.0951 122.0711 52.4460 43.6807 176.3234 42 T 4.3929 8.8157 120.8550 63.3249 68.9023 175.3768 43 A 3.9783 8.6296 126.3538 55.6272 18.2566 180.7634 44 R 3.9557 7.9073 115.7971 59.2268 29.9273 178.6368 45 Q 4.0148 8.1324 117.6534 59.2121 28.7497 179.2633 46 I 4.5004 7.7387 115.2060 63.5344 37.6739 177.8930 47 E 3.9621 8.0151 120.2165 58.9122 29.4621 178.6526 48 A 4.0103 8.7295 121.0326 55.1283 17.5505 179.5054 49 A 3.8975 8.5404 119.4775 54.6611 18.3171 179.7944 50 R 3.9461 7.9238 117.7034 59.0900 30.1896 178.1628 51 R 3.8473 8.3199 118.7231 59.7649 29.8907 178.4458 52 A 4.0519 7.9619 118.8597 54.7137 18.4697 179.1566 53 M 4.1047 7.3241 117.6899 59.3279 32.4820 178.6614 54 T 4.0061 8.0768 115.7199 66.0928 68.2609 176.6519 55 R 3.8263 7.5369 120.1335 59.4203 30.1430 177.9888 56 A 4.0803 7.3133 117.4714 55.5228 18.5473 179.9012 57 V 3.5353 7.6918 108.9383 63.4404 32.1622 178.7208 58 K 3.5200 7.9695 117.7008 57.5127 30.9486 178.2522 59 R 4.3087 8.3535 117.9501 56.2735 28.2384 175.7564 60 Q 4.3844 7.2864 117.2244 55.0590 33.4319 176.8756 61 G 3.7801 8.6670 110.8705 44.4365 0.0000 171.9975 62 K 4.4435 8.0034 118.0400 54.4669 35.5455 175.8689 63 I 5.2548 7.4523 124.4915 58.3049 40.7862 174.5802 64 W 5.1616 8.7722 124.9911 54.9743 33.8045 174.5981 65 I 4.5154 8.1766 120.8260 60.1940 39.0336 175.4851 66 R 4.1189 8.7211 127.6170 58.5018 30.9330 178.2239 67 V 3.8631 7.5840 112.5359 60.5506 32.0852 174.9850 68 F 4.6362 8.2652 126.9505 55.8967 41.0074 172.9861 69 P 3.3794 0.0000 0.0000 61.5600 31.4591 175.8451 70 D 4.8834 7.5348 123.9763 55.1525 41.6789 174.2936 71 K 4.3050 7.8917 116.1560 55.4634 34.5228 174.5921 72 P 3.4386 0.0000 0.0000 62.7869 30.1115 176.0097 73 I 3.3178 8.9548 127.6384 62.3022 36.4878 172.3454 74 T 4.7171 7.8669 114.3697 59.9276 71.7077 173.4731 75 E 4.6679 8.2323 121.0075 54.6579 33.5685 175.1440 76 K 4.1286 8.7352 126.4771 54.6201 32.7788 175.7418 77 P 4.7393 0.0000 0.0000 62.2759 31.0594 175.5266 78 L 4.0659 8.5758 128.0658 57.2066 41.4276 175.9712 79 A 4.4201 8.5585 119.2887 52.5533 19.5085 178.3052 80 V 4.3787 7.4665 118.7300 61.1079 33.5054 175.9805 81 R 4.1331 8.2490 121.3630 56.2918 30.6485 176.2882 82 M 4.2641 8.3977 119.4448 55.2455 32.9734 176.8486 83 G 4.0247 8.5209 105.4869 46.7905 0.0000 173.2837 84 K 4.4986 8.2718 115.1321 56.1670 34.9516 175.5074 85 G 4.1353 8.0155 104.1430 43.1788 0.0000 174.8972 86 K 4.1586 8.3917 122.6522 54.5270 30.8626 175.7834 87 G 4.0986 8.3422 111.4248 45.3328 0.0000 170.5010 88 N 4.7769 8.6931 120.8344 52.2160 39.1909 174.3443 89 V 3.8299 8.0056 112.0441 61.4611 31.8023 176.5711 90 E 4.6058 8.0696 119.1959 56.6696 32.0834 175.2072 91 Y 4.8263 7.0920 113.4869 56.1183 40.3166 173.7588 92 W 5.5920 9.0303 119.8789 54.9765 32.2222 175.2020 93 V 4.6071 9.3902 119.7457 60.9655 34.6984 172.9815 94 A 4.8521 8.5001 124.6926 49.1128 20.3347 174.5482 95 L 4.4709 8.6749 121.6081 56.4371 42.1459 176.9258 96 I 4.6806 8.3921 117.6189 59.1907 40.6731 174.6108 97 Q 4.8377 8.2264 119.9112 53.4595 33.0071 172.1582 98 P 4.4032 0.0000 0.0000 64.7530 31.7490 176.0038 99 G 4.0473 9.8716 116.0631 46.0080 0.0000 173.6789 100 K 4.0491 8.0400 122.0208 56.1375 33.0568 176.4912 101 V 3.9802 8.6466 126.5642 62.0613 31.7689 176.0188 102 L 4.0889 9.3739 126.8804 56.7494 42.5276 176.6510 103 Y 5.5714 7.5744 113.3844 55.6930 42.3594 173.5146 104 E 5.6291 8.8205 117.4536 55.8372 34.2403 174.1256 105 M 5.3537 10.0182 121.8518 53.6220 35.7885 174.4494 106 D 4.9035 8.6048 118.4236 55.3930 47.3800 175.6941 107 G 4.0873 7.8065 106.7600 45.2300 0.0000 173.5568 108 V 4.0853 7.3688 114.4304 59.8582 33.0981 170.1650 109 P 4.4866 0.0000 0.0000 62.1857 31.8144 176.2156 110 E 3.9638 8.2289 117.9861 55.7637 26.7520 174.5966 111 E 4.4955 7.1029 130.1391 56.7264 37.4300 176.5072 112 L 4.0791 7.7232 120.6937 56.1893 42.7589 178.2141 113 A 3.9902 7.1859 120.1363 55.3020 19.4078 179.3912 114 R 2.8401 7.3066 116.3677 59.0656 29.9318 177.9334 115 E 4.0211 8.0526 118.0662 58.1492 29.7855 178.3781 116 A 4.0403 7.4910 120.6811 54.9370 18.1536 178.5955 117 F 4.8306 7.5960 112.8561 58.2435 38.4092 177.0793 118 K 4.1470 7.7055 121.8564 58.2048 32.2697 177.3055 119 L 4.3544 7.3133 116.2406 55.2221 42.3830 176.4695 120 A 4.5200 7.6774 119.2970 52.8155 21.4738 178.3376 121 A 3.9107 7.8458 118.6286 55.4120 18.4472 179.0580 122 A 4.2232 7.3780 112.3530 53.4592 18.2202 177.8992 123 K 4.3851 7.7554 114.6777 56.2519 33.2898 176.7516 124 L 4.4809 7.6910 119.2171 53.4787 42.6611 174.5210 125 P 4.8509 0.0000 0.0000 62.2339 31.5448 175.1333 126 I 4.5865 7.4104 111.3443 58.9816 40.2757 174.4429 127 K 4.0059 8.8110 122.8880 58.1717 32.4131 175.8859 128 T 5.5807 8.4683 112.9652 59.1287 72.0017 172.8190 129 T 4.7040 8.1508 117.8456 60.4575 70.9065 172.0847 130 F 5.3167 8.7836 125.7822 56.9399 40.7296 174.8259 131 V 4.5642 7.8660 125.1348 60.7606 34.9405 174.7234 132 T 4.5197 8.5168 116.1436 61.4260 67.4043 174.8140 133 K 4.0903 8.4893 115.2274 56.9207 34.7945 171.9367 134 T 3.5344 7.9751 121.6407 62.5359 69.9655 169.9332 135 V 3.5566 8.9080 126.5458 64.2462 30.3878 175.3609 136 M 4.1284 9.1065 118.3580 55.5807 32.0991 174.3950 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 8.30 4.17 0.00 2.02 1.46 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 2 L 8.24 3.12 0.00 1.52 1.41 0.90 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 7.97 4.17 0.00 0.93 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.88 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 4 P 0.00 4.12 0.00 2.23 2.02 0.00 2.93 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 1.10 1.76 0.00 5 K 8.78 3.87 0.00 1.67 1.86 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.50 7.81 6 R 7.26 4.72 0.00 1.89 1.85 0.00 3.10 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 1.46 1.62 0.00 7 T 7.83 4.43 4.40 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 0.00 0.00 0.00 1.49 0.00 0.00 8 K 8.77 4.12 0.00 1.69 1.43 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 1.33 7.81 9 F 7.83 4.73 0.00 3.01 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 10 R 9.12 4.20 0.00 1.84 2.00 0.00 3.37 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 11 K 7.80 4.54 0.00 1.67 1.60 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.22 1.38 7.81 12 M 8.14 4.41 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 13 H 7.94 4.48 0.00 3.10 3.16 0.00 5.83 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.54 4.78 0.00 1.72 1.80 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.16 1.18 7.81 15 G 7.99 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 0.00 0.00 0.00 16 R 7.88 4.51 0.00 1.92 1.90 0.00 3.04 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.43 0.00 17 N 8.63 4.59 0.00 2.74 2.81 0.00 0.00 6.80 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 18 R 8.30 4.52 0.00 1.75 1.84 0.00 3.50 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.56 0.00 19 G 8.54 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 20 L 8.47 3.44 0.00 1.84 1.83 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.21 4.39 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 22 Q 8.54 4.51 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.32 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 23 G 7.69 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 24 T 7.17 4.20 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 25 D 7.69 4.43 0.00 2.64 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.93 4.17 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 0.98 0.00 0.00 0.95 0.00 0.00 27 S 8.45 4.38 0.00 3.79 3.43 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 28 F 7.80 4.13 0.00 2.68 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.81 4.51 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 0.00 0.00 0.00 30 S 8.57 4.49 0.00 3.43 3.88 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 0.00 0.00 0.00 31 F 8.21 5.09 0.00 3.09 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 32 G 8.92 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.45 5.10 0.00 0.96 1.40 0.46 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 34 K 9.21 4.12 0.00 2.00 1.76 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.47 7.81 35 A 8.59 4.05 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 36 V 8.31 3.25 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 0.80 0.00 0.00 0.97 0.00 0.00 37 G 7.22 4.34 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 0.00 38 R 8.16 4.62 0.00 1.78 1.85 0.00 3.21 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 39 G 7.06 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.39 4.86 0.00 1.82 1.90 0.00 3.08 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 41 L 8.10 4.96 0.00 1.62 1.64 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.82 4.39 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 43 A 8.63 3.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.91 3.96 0.00 1.85 1.97 0.00 3.10 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 45 Q 8.13 4.01 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 46 I 7.74 4.50 1.86 0.00 0.00 0.74 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 0.27 0.90 0.00 0.00 47 E 8.02 3.96 0.00 2.31 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 2.32 2.48 0.00 48 A 8.73 4.01 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 49 A 8.54 3.90 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 50 R 7.92 3.95 0.00 2.36 2.22 0.00 3.19 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 51 R 8.32 3.85 0.00 1.99 2.12 0.00 3.15 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 52 A 7.96 4.05 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 53 M 7.32 4.10 0.00 2.34 2.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.61 0.00 54 T 8.08 4.01 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 1.20 0.00 0.00 55 R 7.54 3.83 0.00 1.87 2.02 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 56 A 7.31 4.08 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 57 V 7.69 3.54 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 0.75 0.00 0.00 0.94 0.00 0.00 58 K 7.97 3.52 0.00 1.91 1.66 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.57 7.81 59 R 8.35 4.31 0.00 1.76 1.85 0.00 3.19 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 60 Q 7.29 4.38 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 61 G 8.67 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 62 K 8.00 4.44 0.00 1.55 0.98 0.00 1.27 0.00 0.00 1.68 0.00 0.00 3.27 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.21 7.81 63 I 7.45 5.25 1.78 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 1.39 1.76 0.99 0.00 0.00 64 W 8.77 5.16 0.00 3.33 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 65 I 8.18 4.52 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.66 0.73 0.00 0.00 66 R 8.72 4.12 0.00 1.90 1.97 0.00 3.20 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 67 V 7.58 3.86 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 0.63 0.00 0.00 0.74 0.00 0.00 68 F 8.27 4.64 0.00 2.92 2.88 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 0.00 0.00 0.00 69 P 0.00 3.38 0.00 1.57 1.73 0.00 2.20 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.79 0.00 70 D 7.53 4.88 0.00 3.20 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 71 K 7.89 4.30 0.00 1.95 2.01 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.43 7.81 72 P 0.00 3.44 0.00 2.02 1.44 0.00 3.68 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 73 I 8.95 3.32 1.33 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.02 0.28 0.00 0.00 74 T 7.87 4.72 4.54 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 1.07 0.00 0.00 75 E 8.23 4.67 0.00 1.87 1.86 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 2.28 2.30 0.00 76 K 8.74 4.13 0.00 1.76 1.71 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.41 1.46 7.81 77 P 0.00 4.74 0.00 2.07 1.62 0.00 3.71 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 2.03 2.09 0.00 78 L 8.58 4.07 0.00 1.59 1.43 0.92 0.96 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 79 A 8.56 4.42 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 80 V 7.47 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 0.84 0.00 0.00 0.93 0.00 0.00 81 R 8.25 4.13 0.00 1.82 1.91 0.00 3.20 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 82 M 8.40 4.26 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 83 G 8.52 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 0.00 0.00 0.00 84 K 8.27 4.50 0.00 1.69 1.74 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.36 7.81 85 G 8.02 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 86 K 8.39 4.16 0.00 1.72 1.76 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.41 7.81 87 G 8.34 4.10 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 0.00 0.00 0.00 88 N 8.69 4.78 0.00 2.81 2.96 0.00 0.00 6.25 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 89 V 8.01 3.83 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 0.36 0.00 0.00 0.75 0.00 0.00 90 E 8.07 4.61 0.00 2.04 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 0.00 2.23 2.20 0.00 91 Y 7.09 4.83 0.00 2.98 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 92 W 9.03 5.59 0.00 3.26 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 93 V 9.39 4.61 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 0.62 0.00 0.00 1.08 0.00 0.00 94 A 8.50 4.85 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 95 L 8.67 4.47 0.00 1.55 1.90 0.94 0.92 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 96 I 8.39 4.68 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.92 1.02 0.00 0.00 97 Q 8.23 4.84 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 98 P 0.00 4.40 0.00 2.10 2.07 0.00 3.57 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 2.14 0.00 99 G 9.87 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 K 8.04 4.05 0.00 1.85 1.82 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.69 7.81 101 V 8.65 3.98 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 0.81 0.00 0.00 1.07 0.00 0.00 102 L 9.37 4.09 0.00 1.61 1.22 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.57 5.57 0.00 2.48 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 0.00 104 E 8.82 5.63 0.00 2.38 2.28 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 2.72 2.56 0.00 105 M 10.02 5.35 0.00 2.02 1.75 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.15 0.00 106 D 8.60 4.90 0.00 2.64 2.54 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 0.00 107 G 7.81 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 0.00 108 V 7.37 4.09 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 0.59 0.00 0.00 0.85 0.00 0.00 109 P 0.00 4.49 0.00 2.17 2.07 0.00 3.57 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 2.12 2.12 0.00 110 E 8.23 3.96 0.00 2.05 1.77 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 2.44 2.36 0.00 111 E 7.10 4.50 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 112 L 7.72 4.08 0.00 1.59 1.56 0.84 0.91 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 0.00 113 A 7.19 3.99 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 0.00 114 R 7.31 2.84 0.00 0.76 1.42 0.00 2.83 0.00 0.00 2.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.00 115 E 8.05 4.02 0.00 2.17 1.81 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 2.20 2.37 0.00 116 A 7.49 4.04 1.29 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 0.00 117 F 7.60 4.83 0.00 3.31 3.07 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 0.00 0.00 0.00 118 K 7.71 4.15 0.00 1.68 1.82 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.52 7.81 119 L 7.31 4.35 0.00 1.75 1.63 0.90 0.96 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 0.00 120 A 7.68 4.52 1.22 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 0.00 121 A 7.85 3.91 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.38 4.22 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 0.00 123 K 7.76 4.39 0.00 1.82 1.84 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.49 7.81 124 L 7.69 4.48 0.00 1.74 1.63 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.85 0.00 2.18 2.13 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.27 0.00 126 I 7.41 4.59 1.89 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 1.61 0.45 1.00 0.00 0.00 127 K 8.81 4.01 0.00 1.80 1.93 0.00 1.53 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.68 7.81 128 T 8.47 5.58 4.51 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 1.44 0.00 0.00 129 T 8.15 4.70 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 1.29 0.00 0.00 130 F 8.78 5.32 0.00 3.09 3.07 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 0.00 0.00 0.00 131 V 7.87 4.56 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 0.92 0.00 0.00 0.98 0.00 0.00 132 T 8.52 4.52 4.17 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 1.32 0.00 0.00 133 K 8.49 4.09 0.00 1.51 1.60 0.00 1.80 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.21 1.31 7.81 134 T 7.98 3.53 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 1.23 0.00 0.00 135 V 8.91 3.56 2.06 0.00 0.00 0.00 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 0.92 0.00 0.00 136 M 9.11 4.13 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00