NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4473 8.1885 117.0995 57.6835 63.9555 174.2610 9 A 3.9051 8.6087 128.7924 53.6156 18.2056 177.5380 10 A 3.9998 8.2730 120.3841 56.2828 18.8734 178.6845 11 M 4.0661 8.0253 118.1780 59.6845 31.4796 180.1763 12 A 4.2036 8.1382 121.7953 55.2059 18.5533 179.6181 13 E 3.9438 8.4392 117.1748 59.5109 29.5434 179.3727 14 Q 3.9966 8.1345 119.6007 59.3399 29.1717 178.5238 15 R 4.0013 8.3045 119.3363 59.5173 30.0384 178.5571 16 H 4.2864 8.5848 118.2336 59.3112 29.8999 177.1089 17 Q 3.9703 8.2748 121.4035 59.3061 28.9899 178.1345 18 E 4.0499 8.4149 119.6620 59.0077 29.4867 179.1749 19 W 4.4033 8.4675 128.4918 60.6470 30.7817 178.1106 20 L 3.6231 8.0771 118.9902 57.4950 40.8784 179.4670 21 R 3.7830 7.9898 118.8360 59.2528 29.9134 178.3419 22 F 3.9507 7.9513 119.9037 61.2160 39.3983 177.1079 23 V 3.0781 7.1596 117.7293 66.1284 31.1855 177.7835 24 D 4.2504 8.0653 118.6405 56.8212 40.5499 178.4764 25 L 3.7848 7.8243 121.1388 58.1094 42.0705 178.8869 26 L 3.6735 7.5398 120.4151 57.5994 41.9760 178.5241 27 K 3.8784 7.8629 119.7503 59.9448 31.9698 178.5005 28 N 4.3536 8.1358 116.2118 55.9936 38.2902 177.2975 29 A 3.9238 8.0540 122.4197 55.4670 18.6249 179.1613 30 Y 3.9908 8.0741 115.2458 61.5200 37.7342 179.1613 31 Q 4.1670 8.0145 117.1446 57.9889 28.7956 177.4555 32 N 4.8130 7.5383 115.0131 51.8303 39.1616 174.1901 33 D 4.5469 7.8449 118.3827 55.8424 39.1667 174.2528 34 L 4.5962 7.9877 116.4826 54.6421 42.7591 178.3892 35 H 3.8555 8.0179 117.1208 58.5991 28.1584 177.4367 36 L 3.8665 7.2985 121.1714 57.0891 41.6318 177.6155 37 P 4.2288 0.0000 0.0000 65.2872 31.1731 178.4595 38 L 3.9459 7.9035 119.2990 58.2480 42.1408 179.1464 39 L 4.0865 8.1697 119.0088 57.7021 41.2753 179.2336 40 N 4.4242 8.1570 116.1069 55.8525 38.4827 177.0244 41 L 4.1003 7.7421 121.1798 58.5408 42.3983 178.6312 42 M 4.2883 8.2180 116.8447 55.9965 32.3227 176.3604 43 L 4.9325 7.0317 117.5167 52.8528 44.7417 176.7147 44 T 4.3816 8.8871 112.2790 60.3141 71.3843 174.2032 45 P 4.2579 0.0000 0.0000 66.1273 31.3530 178.7736 46 D 4.3972 8.0617 116.9647 57.3038 40.7554 178.5338 47 E 4.0375 8.1905 119.0493 59.1903 29.4658 179.3968 48 R 3.9596 8.1034 118.2810 59.1714 30.1481 178.6759 49 E 3.9070 8.3882 118.8462 59.2508 29.6040 178.6769 50 A 4.0237 8.1277 120.7921 55.2702 18.4383 179.6648 51 L 4.0997 8.2337 117.6514 57.7376 41.5427 179.9297 52 G 3.6406 8.1848 105.8188 48.1386 0.0000 175.9128 53 T 3.9199 8.0500 118.2286 66.4758 68.4320 177.0363 54 R 3.9223 8.4173 120.4053 59.0962 29.9395 179.2668 55 V 3.5875 7.8243 118.1669 66.0067 31.5603 178.0714 56 R 3.8664 7.7868 118.5331 59.3596 29.8328 178.4240 57 I 3.7002 7.9704 119.7374 64.5255 37.1183 178.3691 58 I 3.6757 7.8854 120.5099 64.3285 36.9703 177.9219 59 E 3.8940 8.3690 120.2592 59.6515 29.4723 178.9046 60 E 4.0490 8.3106 118.2903 59.1647 29.2497 179.3270 61 L 4.0241 7.9700 118.7718 57.7577 41.7366 179.1881 62 L 4.1515 7.9536 118.2410 57.4594 41.6015 179.1706 63 R 4.0527 7.8294 118.3331 58.2135 30.1039 177.7522 64 G 3.8975 7.8797 104.2431 45.7317 0.0000 173.5668 65 E 4.1639 8.1348 121.0822 58.0095 30.2021 176.5338 66 M 5.0164 7.9421 116.6870 53.4804 33.3746 176.7501 67 S 4.4992 8.4857 118.0523 57.7978 65.7903 175.4001 68 Q 3.9972 8.5029 121.1287 59.0465 28.5449 179.2418 69 R 4.0129 7.9357 116.6898 58.9474 29.8082 178.3661 70 E 3.9544 8.0937 119.8692 59.1100 29.5292 178.7380 71 L 4.0139 8.1762 119.2778 57.4232 41.6614 179.2609 72 K 4.2525 8.0312 120.9521 59.2071 31.9332 178.6411 73 N 4.4298 7.9495 117.2844 56.8767 38.4934 177.5878 74 E 4.1974 8.1605 118.8610 60.2345 30.0974 180.3291 75 L 4.7090 8.1868 117.5403 53.8764 42.5497 177.8943 76 G 3.8499 7.9108 106.0824 45.4368 0.0000 173.2282 77 A 4.3711 7.5973 122.8513 50.8031 20.0023 178.0952 78 G 3.9147 8.3465 108.2677 44.2775 0.0000 174.9185 79 I 3.7075 8.3240 121.4507 64.3412 37.0868 178.6246 80 A 3.9822 7.9692 121.0012 55.3948 18.2410 179.7169 81 T 3.8135 7.8099 113.7493 66.8495 68.5616 176.8759 82 I 3.7220 7.7164 121.6993 64.7132 37.0285 178.6482 83 T 3.8635 8.1968 116.7874 66.5870 68.2131 176.8693 84 R 4.0091 8.0968 120.1808 59.1536 30.0808 179.2601 85 G 3.6273 8.0140 105.3953 47.8728 0.0000 175.5921 86 S 4.1024 8.2903 116.1732 61.2382 62.4075 176.0671 87 N 4.3886 8.4952 119.4632 56.4180 38.0104 177.6948 88 S 4.1863 8.0771 115.9906 61.3107 63.0674 176.0948 89 L 4.1251 8.1687 123.3047 58.0748 41.6067 179.2020 90 K 4.0312 7.9887 117.3751 58.8050 32.0642 178.4995 91 A 4.2631 7.5933 118.8385 52.4150 19.0467 177.6109 92 A 4.1968 6.8240 120.2191 50.9134 19.4484 176.2747 93 P 4.3701 0.0000 0.0000 62.4594 33.0731 177.9485 94 V 3.6415 8.5719 121.5049 66.3282 31.4473 178.1705 95 E 3.9824 8.1834 116.7145 59.3405 29.2742 178.8536 96 L 4.0481 7.8812 120.7753 57.8619 42.2959 178.6220 97 R 3.9452 7.9860 118.5247 59.6406 30.1561 178.4356 98 Q 4.1925 8.4275 118.0146 58.7663 28.7159 178.7006 99 W 4.3569 8.2657 129.1209 60.5839 30.7199 177.9585 100 L 3.6902 8.5118 119.2940 57.8105 41.1755 179.3296 101 E 3.9302 8.3478 118.4960 59.4996 29.1372 179.3437 102 E 3.9980 7.7021 117.3211 59.0434 29.5613 179.0719 103 V 3.7247 7.1004 110.9730 63.0836 32.1699 177.9063 104 L 4.1592 7.9185 117.5270 54.7764 42.2176 176.8031 105 L 4.6833 6.6234 116.8790 52.5086 43.6054 176.5613 106 K 4.2212 8.2561 121.3331 55.8503 32.8626 177.3947 107 S 4.2712 8.4301 117.9477 58.9567 63.4692 174.3737 108 D 4.5103 8.4392 122.3118 54.5758 41.3076 175.8467 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 8 S 8.19 4.45 0.00 3.67 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 9 A 8.61 3.91 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 0.00 0.00 0.00 0.00 0.00 10 A 8.27 4.00 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 11 M 8.03 4.07 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.17 0.00 12 A 8.14 4.20 1.40 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 0.00 0.00 0.00 13 E 8.44 3.94 0.00 2.19 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 2.35 2.33 0.00 14 Q 8.13 4.00 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.11 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 15 R 8.30 4.00 0.00 2.07 2.01 0.00 3.18 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 16 H 8.58 4.29 0.00 3.32 3.51 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 8.27 3.97 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 18 E 8.41 4.05 0.00 2.31 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 2.37 2.52 0.00 19 W 8.47 4.40 0.00 3.40 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 20 L 8.08 3.62 0.00 1.78 1.58 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.99 3.78 0.00 2.02 2.11 0.00 3.10 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 22 F 7.95 3.95 0.00 3.19 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 23 V 7.16 3.08 1.74 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 0.85 0.00 0.00 -0.12 0.00 0.00 24 D 8.07 4.25 0.00 2.60 2.60 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 25 L 7.82 3.78 0.00 1.75 1.60 0.86 0.45 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 26 L 7.54 3.67 0.00 1.02 1.37 0.66 0.94 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 27 K 7.86 3.88 0.00 1.89 1.93 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.45 7.81 28 N 8.14 4.35 0.00 2.74 2.82 0.00 0.00 6.94 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 29 A 8.05 3.92 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 30 Y 8.07 3.99 0.00 3.13 2.90 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 0.00 0.00 0.00 31 Q 8.01 4.17 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 32 N 7.54 4.81 0.00 2.60 2.81 0.00 0.00 7.03 9.09 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 33 D 7.84 4.55 0.00 2.87 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 34 L 7.99 4.60 0.00 1.61 1.58 0.89 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.02 3.86 0.00 2.49 2.51 0.00 5.46 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 36 L 7.30 3.87 0.00 1.55 1.69 0.93 0.98 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 37 P 0.00 4.23 0.00 2.11 2.07 0.00 3.49 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 2.05 2.09 0.00 38 L 7.90 3.95 0.00 1.79 1.70 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.17 4.09 0.00 1.72 1.75 0.94 1.05 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 40 N 8.16 4.42 0.00 2.85 2.88 0.00 0.00 6.97 7.47 0.00 0.00 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 L 7.74 4.10 0.00 1.64 1.90 0.93 0.81 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 42 M 8.22 4.29 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.96 0.00 43 L 7.03 4.93 0.00 1.78 1.57 1.00 0.81 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 44 T 8.89 4.38 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 1.26 0.00 0.00 45 P 0.00 4.26 0.00 2.18 2.16 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 46 D 8.06 4.40 0.00 2.69 2.72 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 47 E 8.19 4.04 0.00 2.23 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 2.34 0.00 48 R 8.10 3.96 0.00 2.05 2.00 0.00 3.15 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 49 E 8.39 3.91 0.00 2.13 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 0.00 2.31 2.34 0.00 50 A 8.13 4.02 1.40 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 0.00 0.00 0.00 51 L 8.23 4.10 0.00 1.76 1.78 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.18 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 53 T 8.05 3.92 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 1.22 0.00 0.00 54 R 8.42 3.92 0.00 1.99 2.00 0.00 3.15 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 55 V 7.82 3.59 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 1.17 0.00 0.00 1.03 0.00 0.00 56 R 7.79 3.87 0.00 1.91 2.08 0.00 3.35 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 57 I 7.97 3.70 2.02 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 1.53 0.60 0.92 0.00 0.00 58 I 7.89 3.68 1.89 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 1.58 0.88 0.93 0.00 0.00 59 E 8.37 3.89 0.00 2.06 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 0.00 2.29 2.34 0.00 60 E 8.31 4.05 0.00 2.03 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 2.52 2.49 0.00 61 L 7.97 4.02 0.00 1.76 1.73 0.93 1.05 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 62 L 7.95 4.15 0.00 1.75 1.71 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.83 4.05 0.00 1.81 1.95 0.00 3.28 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 1.72 1.63 0.00 64 G 7.88 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.13 4.16 0.00 1.91 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 2.25 2.38 0.00 66 M 7.94 5.02 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 67 S 8.49 4.50 0.00 4.05 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 68 Q 8.50 4.00 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 69 R 7.94 4.01 0.00 2.03 2.18 0.00 2.97 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 70 E 8.09 3.95 0.00 2.07 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 0.00 2.30 2.35 0.00 71 L 8.18 4.01 0.00 1.94 1.70 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.03 4.25 0.00 1.83 2.01 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.50 7.81 73 N 7.95 4.43 0.00 2.77 2.86 0.00 0.00 7.01 7.14 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 74 E 8.16 4.20 0.00 2.09 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 2.25 2.21 0.00 75 L 8.19 4.71 0.00 1.66 1.74 0.92 1.22 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 G 7.91 3.85 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 0.00 0.00 0.00 77 A 7.60 4.37 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 78 G 8.35 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 0.00 0.00 0.00 79 I 8.32 3.71 1.87 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 1.57 0.89 0.91 0.00 0.00 80 A 7.97 3.98 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 81 T 7.81 3.81 4.41 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 1.21 0.00 0.00 82 I 7.72 3.72 1.98 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 1.52 0.78 0.91 0.00 0.00 83 T 8.20 3.86 4.39 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 1.21 0.00 0.00 84 R 8.10 4.01 0.00 2.05 1.97 0.00 3.12 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 1.64 1.79 0.00 85 G 8.01 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 86 S 8.29 4.10 0.00 3.89 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 87 N 8.50 4.39 0.00 2.93 2.85 0.00 0.00 7.10 7.29 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 88 S 8.08 4.19 0.00 4.02 3.93 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 89 L 8.17 4.13 0.00 1.92 1.83 0.95 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.99 4.03 0.00 2.00 1.86 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.46 7.81 91 A 7.59 4.26 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 92 A 6.82 4.20 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 93 P 0.00 4.37 0.00 2.18 1.99 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 94 V 8.57 3.64 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 1.30 0.00 0.00 0.95 0.00 0.00 95 E 8.18 3.98 0.00 2.21 2.21 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 2.36 2.29 0.00 96 L 7.88 4.05 0.00 1.81 1.93 1.06 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 97 R 7.99 3.95 0.00 2.00 2.12 0.00 3.17 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 98 Q 8.43 4.19 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 99 W 8.27 4.36 0.00 3.49 3.42 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 0.00 100 L 8.51 3.69 0.00 1.92 1.68 1.02 0.99 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 0.00 101 E 8.35 3.93 0.00 2.17 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 2.51 0.00 102 E 7.70 4.00 0.00 1.96 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 2.32 2.45 0.00 103 V 7.10 3.72 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 0.18 0.00 0.00 -0.00 0.00 0.00 104 L 7.92 4.16 0.00 1.59 1.65 0.88 0.76 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 0.00 105 L 6.62 4.68 0.00 1.76 1.53 0.89 0.85 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 0.00 106 K 8.26 4.22 0.00 1.72 1.71 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.38 7.81 107 S 8.43 4.27 0.00 3.84 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 0.00 108 D 8.44 4.51 0.00 2.60 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