NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9323 8.0549 120.3847 62.9177 32.0220 174.1634 2 H 4.7949 7.6721 118.8749 52.9294 31.3929 173.6022 3 L 4.3672 8.0610 122.6243 54.6777 43.2673 177.6822 4 T 4.2513 8.5212 113.6283 60.5349 71.0675 174.1429 5 P 4.2047 0.0000 0.0000 65.8557 31.3355 178.8098 6 E 3.9841 8.1103 115.8008 59.4019 29.4578 178.9615 7 E 3.9310 8.0976 119.5873 59.0189 29.4895 179.2680 8 K 3.8391 8.2166 118.7409 59.6604 32.0470 179.4902 9 S 4.0964 8.2170 115.0751 61.4909 62.7316 176.6606 10 A 3.9833 8.1237 123.4401 55.0674 18.1310 179.8126 11 V 3.4795 7.8870 116.8105 66.5409 31.7166 178.4193 12 T 3.9590 8.1045 115.2635 66.5051 68.0448 176.5347 13 A 4.0446 8.1079 121.9304 55.2066 18.7295 179.1736 14 L 3.9042 8.1236 118.8988 58.0030 42.1094 178.9859 15 W 4.3444 8.7055 128.5277 60.0701 30.4806 177.8068 16 G 3.8387 8.1480 104.0933 46.3545 0.0000 173.9385 17 K 4.4511 7.8742 118.9274 56.1519 33.1091 176.5333 18 V 3.5612 7.4057 120.3107 61.8843 31.9945 175.7006 19 N 4.4614 8.2379 125.4552 52.5453 38.9030 175.5345 20 V 3.4850 8.0774 128.3918 65.9958 31.8260 177.2338 21 D 4.3522 8.0854 118.0715 57.4480 40.6936 178.6175 22 E 3.8721 8.3440 118.8362 59.5471 29.4998 179.6647 23 V 3.5681 8.0215 118.6791 65.6408 31.4486 178.4067 24 G 3.6352 8.4251 106.1217 47.6921 0.0000 175.9935 25 G 3.6111 8.1028 108.7010 47.4179 0.0000 175.4190 26 E 3.8889 8.3648 121.6683 58.7617 29.5633 178.8272 27 A 3.9051 8.1409 121.0068 55.0509 18.4928 179.4090 28 L 3.9510 8.0710 119.0818 58.0516 42.2859 179.2422 29 G 3.5966 8.1409 105.7208 48.1274 0.0000 175.8719 30 R 3.9050 8.1217 121.1031 58.5013 29.9866 178.9298 31 L 4.0105 8.0432 120.4763 58.2689 42.2632 179.0884 32 L 4.1020 7.9043 119.8006 56.3858 41.2600 179.5077 33 V 3.6130 7.1456 117.4030 65.5763 31.7800 177.8591 34 V 3.5406 7.7362 117.0363 64.2806 32.7883 175.6395 35 Y 3.7666 7.2151 115.7934 54.5427 37.8153 174.3000 36 P 4.8334 0.0000 0.0000 63.8831 31.9868 177.7511 37 W 4.3795 8.0675 115.7038 59.1731 27.9996 177.6838 38 T 4.2503 7.7861 110.5849 63.7307 68.1873 175.9094 39 Q 4.3392 8.2444 121.6197 57.9045 28.4666 178.0551 40 R 3.7173 7.5817 116.3547 58.6856 29.3207 177.5970 41 F 4.1579 6.8373 114.6064 57.9138 39.2967 175.8696 42 F 4.4411 7.8101 120.8365 56.5201 39.6351 177.0876 43 E 3.9787 8.4476 121.6449 59.2971 29.2188 177.6813 44 S 4.5568 8.0409 111.2011 58.8712 63.5367 174.2994 45 F 4.7220 8.5078 119.5778 57.6948 39.9786 177.1555 46 G 3.9601 8.0105 107.8520 45.2254 0.0000 175.1713 47 D 4.4955 8.6847 126.9217 54.3808 40.7877 175.7086 48 L 4.8889 8.2647 128.6326 54.4750 42.7271 178.3716 49 S 4.3259 8.6740 116.7158 60.6895 63.5188 174.3978 50 T 4.7371 7.4411 109.9773 58.2542 73.0132 172.7073 51 P 4.1897 0.0000 0.0000 66.0284 31.3448 178.6648 52 D 4.3188 8.1210 116.8263 57.3070 40.4985 178.6540 53 A 3.9845 7.9124 120.4924 54.9654 18.7939 179.5846 54 V 3.6836 7.9826 116.8918 66.6040 31.4614 178.3226 55 M 4.2079 8.1394 117.1995 57.6910 31.8650 178.0534 56 G 3.9910 7.7590 103.2651 43.6383 0.0000 173.2318 57 N 4.4672 7.5485 121.4674 52.5364 39.3605 173.9468 58 P 4.2179 0.0000 0.0000 65.7947 31.3380 178.6562 59 K 3.6669 8.2816 118.5291 58.7981 31.7729 179.4405 60 V 3.6691 7.8758 118.1397 65.9937 31.5113 178.0256 61 K 3.8863 8.2110 118.0841 59.3801 32.0032 179.0835 62 A 3.9515 8.0906 121.0895 55.5727 18.2582 179.2422 63 H 4.3571 8.5251 116.9150 59.1569 29.8840 177.5668 64 G 3.6832 8.3722 107.9042 47.8589 0.0000 175.6714 65 K 3.9766 8.2352 121.1153 58.9526 32.1870 179.3944 66 K 3.9627 7.8841 119.4527 59.4857 32.2074 179.0643 67 V 3.6183 8.0584 118.8740 66.1221 31.5700 177.8104 68 L 4.3269 8.3535 119.9960 57.5894 41.8989 179.0360 69 G 3.7445 8.4214 106.0516 47.8185 0.0000 175.5952 70 A 4.1348 8.1153 123.1245 54.7025 18.1938 179.3959 71 F 4.1004 8.3563 118.3055 61.5180 39.8387 176.9234 72 S 4.1210 8.9301 113.0135 61.7217 62.3232 175.8934 73 D 4.4924 8.4011 121.5913 57.3381 40.4349 179.0734 74 G 3.5490 8.0213 106.1207 47.4021 0.0000 175.2871 75 L 3.8130 7.2143 119.2605 56.2823 41.6012 178.1008 76 A 4.2684 7.4732 119.5741 52.5239 19.4619 176.6199 77 H 4.9193 8.1708 115.5206 54.9556 29.8208 175.6675 78 L 3.8740 8.0172 120.0872 57.4733 41.8513 178.2545 79 D 4.7199 7.8850 116.0261 54.2698 41.6427 176.4731 80 N 4.9754 8.1282 119.0145 51.2186 39.6080 175.8592 81 L 4.0596 8.0077 121.3844 57.8204 42.0496 179.2608 82 K 4.1020 8.1001 118.1306 59.4027 31.8482 179.4212 83 G 3.5631 7.6858 104.6403 48.2126 0.0000 175.4289 84 T 3.7685 7.6852 117.2707 65.5038 68.5975 175.7268 85 F 4.7790 8.0077 116.6908 56.9436 39.3743 177.2856 86 A 4.0743 7.7589 122.9376 55.9292 18.2248 180.4062 87 T 3.8870 7.8645 113.4634 66.7338 68.5073 176.9234 88 L 4.1418 7.9915 120.5368 57.5956 41.6841 179.3357 89 S 4.4055 8.3469 114.9183 61.0239 62.4198 175.9721 90 E 3.9061 8.3037 121.2545 59.3008 29.2180 179.1812 91 L 3.9036 8.0272 120.1512 58.6701 42.2026 178.8758 92 H 4.2167 8.6333 116.3139 58.7287 28.3449 177.3282 93 C 3.5480 7.7511 120.7292 62.3539 31.1736 175.3975 94 D 4.2150 8.2951 120.0431 56.3658 40.5273 177.4035 95 K 4.3298 7.8362 116.9562 57.2077 33.9753 177.2761 96 L 4.2233 7.7072 116.3167 54.7066 42.4370 175.9497 97 H 4.0310 7.1368 114.2481 56.6082 26.5928 175.5348 98 V 3.9699 7.9387 119.2946 61.2356 31.6962 174.9124 99 D 4.3604 8.8842 127.5584 54.0470 41.5618 175.4440 100 P 3.3360 0.0000 0.0000 64.6507 31.8119 177.8802 101 E 3.8851 8.3318 119.1451 59.3447 29.2077 178.3870 102 N 4.2442 8.0393 116.5497 56.4068 38.5452 177.2493 103 F 4.4601 7.3978 119.0104 60.5787 38.9446 178.0190 104 R 3.9961 7.8057 117.3640 59.1526 30.0184 178.7904 105 L 3.8108 7.9754 118.8745 57.6382 41.5215 179.3462 106 L 4.0842 8.2578 120.5435 58.0347 41.9995 179.1665 107 G 3.7005 8.2072 105.7229 47.8984 0.0000 175.3763 108 N 4.4052 8.2129 118.8521 56.1648 38.6010 177.7277 109 V 3.6374 8.0207 119.6553 65.7619 31.5576 177.7592 110 L 3.8698 8.3338 120.5969 58.1185 41.8839 179.0301 111 V 3.5727 7.9531 118.1512 66.3557 31.3768 177.7597 112 C 4.0879 8.0959 116.3594 62.7555 27.9191 176.3306 113 V 3.5059 8.1624 120.2279 65.9089 31.0354 178.0485 114 L 3.8654 8.0516 118.9216 57.6150 41.3339 179.3675 115 A 3.7440 7.3830 120.6688 55.2546 18.0852 179.1872 116 H 4.1118 8.1154 115.8917 59.7086 30.0394 176.7276 117 H 3.9788 8.3188 119.2155 58.6283 29.8865 176.4219 118 F 4.5942 8.5747 118.3347 56.7001 39.8610 177.1869 119 G 3.8084 8.8332 108.5020 46.0253 0.0000 177.1994 120 K 3.9912 8.8748 121.8444 59.3051 32.4949 178.0175 121 E 4.0443 7.9670 119.8414 58.6036 30.0869 177.0792 122 F 4.5777 8.1465 123.5868 56.9903 37.9593 175.2712 123 T 4.1313 7.3107 115.2654 60.5085 71.2199 173.3571 124 P 4.1598 0.0000 0.0000 65.6820 31.3336 177.2451 125 P 4.2032 0.0000 0.0000 65.2801 31.2773 178.9013 126 V 3.5286 7.5054 116.8789 65.8293 31.3594 177.7616 127 Q 3.4680 7.8615 119.4571 59.0449 28.9397 178.0930 128 A 3.9919 8.1015 121.5426 55.2169 18.3742 179.4998 129 A 3.9023 7.9694 119.0566 55.6546 18.4307 179.5826 130 Y 3.9415 8.2726 115.1608 61.1162 37.8998 178.7548 131 Q 4.1430 8.7059 119.7477 58.8365 28.7076 178.8177 132 K 3.9781 7.9860 119.1360 59.3202 31.9813 179.5843 133 V 3.4890 7.6250 118.3537 66.2489 31.5060 178.6385 134 V 3.8150 8.3828 112.3372 64.2069 31.2674 178.4808 135 A 4.1126 8.2577 120.9232 55.0473 18.1591 179.9014 136 G 3.5131 8.3267 104.4761 47.9403 0.0000 176.1574 137 V 3.3541 8.0804 120.9888 65.4184 31.5258 177.9488 138 A 3.8614 8.0844 120.5590 55.2802 18.0360 179.2828 139 N 4.2652 8.2737 113.8980 56.4612 38.8264 177.2076 140 A 4.1655 8.1867 122.2601 55.1987 18.4046 179.7071 141 L 3.9025 8.1208 117.2637 56.9244 41.5076 178.5968 142 A 4.4286 7.8330 119.5720 53.1406 18.8728 178.5229 143 H 4.3362 7.9801 116.3801 58.3366 30.0103 175.7838 144 K 4.4447 8.0224 117.7653 56.1760 32.2670 176.4349 145 Y 4.1247 7.8872 117.4751 58.6849 38.3967 175.9761 146 H 4.4267 8.3323 117.1038 56.2904 28.1172 173.4445 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 V 8.05 3.93 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 0.87 0.00 0.00 0.93 0.00 0.00 2 H 7.67 4.79 0.00 3.25 3.15 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.06 4.37 0.00 1.59 1.54 0.94 0.85 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 4 T 8.52 4.25 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 1.20 0.00 0.00 5 P 0.00 4.20 0.00 2.16 2.13 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 6 E 8.11 3.98 0.00 2.14 2.20 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 2.34 2.33 0.00 7 E 8.10 3.93 0.00 2.26 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 2.29 2.32 0.00 8 K 8.22 3.84 0.00 1.90 1.81 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.61 7.81 9 S 8.22 4.10 0.00 4.02 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 10 A 8.12 3.98 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 11 V 7.89 3.48 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 0.64 0.00 0.00 0.45 0.00 0.00 12 T 8.10 3.96 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 1.26 0.00 0.00 13 A 8.11 4.04 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 14 L 8.12 3.90 0.00 1.83 1.94 0.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.71 4.34 0.00 3.87 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 16 G 8.15 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 17 K 7.87 4.45 0.00 2.18 2.10 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.58 7.81 18 V 7.41 3.56 1.08 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 -0.07 0.00 0.00 0.67 0.00 0.00 19 N 8.24 4.46 0.00 2.68 2.56 0.00 0.00 6.85 7.71 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 20 V 8.08 3.48 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 1.30 0.00 0.00 0.99 0.00 0.00 21 D 8.09 4.35 0.00 2.92 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 22 E 8.34 3.87 0.00 1.90 1.89 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 2.27 2.42 0.00 23 V 8.02 3.57 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 0.97 0.00 0.00 0.66 0.00 0.00 24 G 8.43 3.64 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 0.00 0.00 0.00 25 G 8.10 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.36 3.89 0.00 2.10 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 2.24 2.31 0.00 27 A 8.14 3.91 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 28 L 8.07 3.95 0.00 1.76 1.63 0.92 0.91 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 29 G 8.14 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.12 3.90 0.00 1.91 1.92 0.00 3.08 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 31 L 8.04 4.01 0.00 1.88 1.88 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.90 4.10 0.00 1.89 1.68 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.15 3.61 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 0.72 0.00 0.00 0.94 0.00 0.00 34 V 7.74 3.54 1.56 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 -0.11 0.00 0.00 0.75 0.00 0.00 35 Y 7.22 3.77 0.00 2.58 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 36 P 0.00 4.83 0.00 2.25 2.11 0.00 3.88 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 2.19 2.10 0.00 37 W 8.07 4.38 0.00 3.53 3.44 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 38 T 7.79 4.25 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 1.09 0.00 0.00 39 Q 8.24 4.34 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 40 R 7.58 3.72 0.00 1.58 1.94 0.00 2.89 0.00 0.00 2.85 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.00 41 F 6.84 4.16 0.00 1.51 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 0.00 0.00 0.00 0.00 42 F 7.81 4.44 0.00 2.88 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 0.00 0.00 0.00 43 E 8.45 3.98 0.00 2.08 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 2.25 2.33 0.00 44 S 8.04 4.56 0.00 4.15 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 45 F 8.51 4.72 0.00 3.21 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 46 G 8.01 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 47 D 8.68 4.50 0.00 2.67 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 48 L 8.26 4.89 0.00 1.66 1.63 1.05 1.04 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 49 S 8.67 4.33 0.00 3.97 4.03 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 50 T 7.44 4.74 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.12 4.32 0.00 2.67 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 53 A 7.91 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 54 V 7.98 3.68 2.19 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 1.05 0.00 0.00 0.96 0.00 0.00 55 M 8.14 4.21 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 56 G 7.76 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.55 4.47 0.00 3.01 2.83 0.00 0.00 6.87 7.17 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 58 P 0.00 4.22 0.00 2.24 2.25 0.00 3.72 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 2.01 2.02 0.00 59 K 8.28 3.67 0.00 1.57 0.74 0.00 1.53 0.00 0.00 1.16 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.15 1.25 7.81 60 V 7.88 3.67 2.23 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 1.13 0.00 0.00 1.03 0.00 0.00 61 K 8.21 3.89 0.00 1.94 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.54 7.81 62 A 8.09 3.95 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 63 H 8.53 4.36 0.00 3.60 3.45 0.00 5.80 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 64 G 8.37 3.68 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 0.00 0.00 0.00 65 K 8.24 3.98 0.00 2.00 1.98 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.72 7.81 66 K 7.88 3.96 0.00 1.91 2.00 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.51 7.81 67 V 8.06 3.62 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 0.90 0.00 0.00 68 L 8.35 4.33 0.00 1.93 1.77 0.80 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.42 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.12 4.13 1.57 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 0.00 0.00 71 F 8.36 4.10 0.00 3.07 3.38 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 72 S 8.93 4.12 0.00 4.56 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 73 D 8.40 4.49 0.00 2.87 2.69 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 74 G 8.02 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 0.00 0.00 0.00 75 L 7.21 3.81 0.00 1.45 1.41 -0.43 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.47 4.27 1.10 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 77 H 8.17 4.92 0.00 3.09 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.02 3.87 0.00 1.55 1.66 0.78 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.88 4.72 0.00 2.62 2.65 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 0.00 0.00 0.00 0.00 80 N 8.13 4.98 0.00 2.70 2.61 0.00 0.00 7.19 7.51 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 81 L 8.01 4.06 0.00 1.76 1.84 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.10 4.10 0.00 1.76 1.82 0.00 1.56 0.00 0.00 1.43 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.47 7.81 83 G 7.69 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 84 T 7.69 3.77 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 0.44 0.00 0.00 85 F 8.01 4.78 0.00 3.23 2.91 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 86 A 7.76 4.07 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 87 T 7.86 3.89 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 1.22 0.00 0.00 88 L 7.99 4.14 0.00 2.02 1.84 1.16 0.94 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 89 S 8.35 4.41 0.00 4.18 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 0.00 90 E 8.30 3.91 0.00 2.23 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 2.34 2.49 0.00 91 L 8.03 3.90 0.00 1.79 1.87 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.63 4.22 0.00 3.58 3.74 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.75 3.55 0.00 1.23 2.50 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 94 D 8.30 4.22 0.00 2.69 2.69 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 95 K 7.84 4.33 0.00 1.78 1.78 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.49 7.81 96 L 7.71 4.22 0.00 1.69 1.62 0.69 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.14 4.03 0.00 3.51 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.94 3.97 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 0.19 0.00 0.00 0.43 0.00 0.00 99 D 8.88 4.36 0.00 2.81 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 0.00 100 P 0.00 3.34 0.00 1.96 1.91 0.00 3.38 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.52 0.00 101 E 8.33 3.89 0.00 2.04 1.92 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 2.33 2.41 0.00 102 N 8.04 4.24 0.00 2.44 2.72 0.00 0.00 6.93 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 0.00 103 F 7.40 4.46 0.00 3.12 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 0.00 104 R 7.81 4.00 0.00 2.00 1.97 0.00 3.27 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.98 3.81 0.00 1.68 1.32 0.75 -0.31 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 0.00 106 L 8.26 4.08 0.00 1.88 1.88 0.92 0.96 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 0.00 107 G 8.21 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.21 4.41 0.00 3.00 2.98 0.00 0.00 6.67 7.08 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 0.00 109 V 8.02 3.64 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 1.00 0.00 0.00 1.13 0.00 0.00 110 L 8.33 3.87 0.00 1.71 1.76 0.92 0.33 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 0.00 111 V 7.95 3.57 2.33 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 1.40 0.00 0.00 1.19 0.00 0.00 112 C 8.10 4.09 0.00 3.18 2.93 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 0.00 113 V 8.16 3.51 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 0.93 0.00 0.00 0.89 0.00 0.00 114 L 8.05 3.87 0.00 0.93 1.11 0.66 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.38 3.74 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 0.00 116 H 8.12 4.11 0.00 3.16 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.32 3.98 0.00 2.87 2.90 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.57 4.59 0.00 3.36 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 0.00 119 G 8.83 3.81 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 0.00 0.00 0.00 120 K 8.87 3.99 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 7.97 4.04 0.00 2.02 2.31 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 2.29 2.27 0.00 122 F 8.15 4.58 0.00 3.04 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 0.00 123 T 7.31 4.13 4.21 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 0.00 0.00 0.00 1.29 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.20 0.00 2.11 2.06 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.51 3.53 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 0.99 0.00 0.00 0.90 0.00 0.00 127 Q 7.86 3.47 0.00 1.55 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 128 A 8.10 3.99 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 0.00 129 A 7.97 3.90 1.31 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 0.00 0.00 130 Y 8.27 3.94 0.00 3.27 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 0.00 131 Q 8.71 4.14 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 7.99 3.98 0.00 1.99 1.91 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.61 7.81 133 V 7.62 3.49 2.17 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 0.99 0.00 0.00 0.73 0.00 0.00 134 V 8.38 3.81 2.19 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 0.99 0.00 0.00 1.15 0.00 0.00 135 A 8.26 4.11 1.41 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 0.00 0.00 136 G 8.33 3.51 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 0.00 137 V 8.08 3.35 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 0.59 0.00 0.00 0.76 0.00 0.00 138 A 8.08 3.86 1.41 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 0.00 0.00 139 N 8.27 4.27 0.00 2.87 2.90 0.00 0.00 7.06 7.01 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 0.00 140 A 8.19 4.17 1.48 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 0.00 0.00 141 L 8.12 3.90 0.00 1.08 0.67 -0.13 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.83 4.43 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 0.00 143 H 7.98 4.34 0.00 3.36 3.51 0.00 5.74 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.02 4.44 0.00 1.87 1.85 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.72 7.81 145 Y 7.89 4.12 0.00 3.09 2.97 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 0.00 146 H 8.33 4.43 0.00 3.21 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00