NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.3562 8.3344 115.2846 58.5305 63.7250 172.0977 7 V 3.8523 8.3316 118.4223 63.4826 32.2017 174.7849 8 L 4.9805 7.2377 117.9256 52.4712 45.1509 176.0852 9 S 4.3887 8.7745 117.6333 57.5190 63.7256 175.2429 10 G 3.9493 8.8988 108.2422 48.1989 0.0000 176.2162 11 G 3.6043 7.9600 106.9645 47.7986 0.0000 175.2784 12 E 3.9948 7.9224 121.4757 59.1874 29.5225 179.3677 13 L 4.0431 8.3016 120.3101 58.4928 41.8810 178.8749 14 D 4.4784 7.7052 116.5228 57.2491 40.9689 178.3817 15 K 4.0617 8.2507 118.9394 59.1016 31.9362 179.0060 16 W 4.4902 8.7463 128.6553 60.8881 30.6711 177.8211 17 E 4.9123 8.0816 116.9943 57.6187 29.1316 178.7755 18 K 4.1317 8.0261 118.5946 58.1353 32.7117 177.5629 19 I 4.1967 7.2058 120.5399 61.2547 38.4069 175.5430 20 R 4.7211 9.1811 125.9983 54.6849 30.3752 177.3067 21 L 3.6394 8.2265 123.5282 56.5486 42.6741 177.6959 22 R 4.7739 7.6158 115.8316 53.0444 33.2896 173.3309 23 P 4.9015 0.0000 0.0000 63.6127 31.6436 176.6931 24 G 3.8749 8.8953 109.3078 46.0372 0.0000 173.6662 25 G 3.8541 7.7421 108.5775 44.5937 0.0000 174.7496 26 K 4.0466 8.4596 118.4393 59.3577 33.4056 177.9428 27 K 3.8147 7.9236 119.5906 56.7919 32.6804 175.8699 28 Q 4.8768 8.3481 122.6040 53.7602 32.5890 174.9469 29 Y 3.9399 8.8335 119.5138 58.3545 38.9263 176.5960 30 K 5.0842 8.9702 123.0950 54.4730 35.2444 177.1990 31 L 4.2179 8.6177 119.3447 57.8023 41.3209 179.5014 32 K 3.9486 8.3910 118.5595 60.9360 32.0655 178.5632 33 H 4.6359 8.3791 116.3433 58.4607 28.6436 177.9641 34 I 3.7693 8.1131 121.9584 64.3266 36.9888 178.4627 35 V 3.6094 7.8805 118.6255 65.7934 31.4223 177.6917 36 W 4.0568 8.6322 127.9044 60.4752 30.6753 177.8550 37 A 3.6475 8.4274 120.7760 54.9774 17.7677 179.8763 38 S 3.9946 8.1843 113.7409 61.8795 62.9466 176.9881 39 R 3.8220 7.8448 120.6475 59.2651 29.5449 179.0861 40 E 3.5373 7.6621 118.1642 59.0961 29.4045 179.1201 41 L 4.1498 7.7278 118.9837 58.0873 41.7545 179.4395 42 E 4.0168 8.0522 118.1988 59.5985 29.1700 179.4287 43 R 3.8325 7.4372 116.8108 59.1374 30.0798 178.0196 44 F 4.7302 7.3577 114.2438 56.3222 39.1851 175.3699 45 A 3.7879 8.2795 120.4550 53.3679 16.4714 177.9306 46 V 4.3220 7.9118 118.9131 62.0103 33.8171 174.6698 47 N 4.4375 8.6104 125.5806 52.8377 38.9713 173.7137 48 P 4.4238 0.0000 0.0000 64.7343 32.0059 178.5974 49 G 3.5655 8.6270 106.7655 47.4376 0.0000 175.4651 50 L 4.1239 7.9234 121.0705 57.3292 41.3628 178.7696 51 L 4.2580 7.8790 117.7535 56.3191 41.6415 178.1238 52 E 4.2684 7.9967 118.4706 56.8459 30.0469 175.9670 53 T 4.5454 6.9094 107.6357 58.6955 72.5350 174.9785 54 S 4.2369 8.6273 117.7784 62.0319 62.7291 176.8566 55 E 4.1989 8.2887 120.8326 59.2500 29.1784 179.5792 56 G 4.0233 8.1829 107.0139 47.5587 0.0000 175.1811 57 C 3.9236 8.1697 120.2947 62.5080 28.2914 176.3509 58 R 3.5521 8.4731 120.1139 59.4858 29.7081 177.7909 59 Q 3.9386 8.2304 119.5001 59.7667 28.8912 179.2290 60 I 3.7710 7.9357 120.3564 64.0400 37.1021 178.1794 61 L 4.0685 8.1521 120.4320 58.1140 41.3062 179.8338 62 G 3.7486 7.8746 103.6992 48.1039 0.0000 175.3088 63 Q 4.1572 7.6738 118.8761 58.6694 29.1862 178.1911 64 L 4.1567 8.3065 120.0422 56.9808 41.7650 178.7822 65 Q 3.7604 8.0420 120.0450 59.0901 28.7774 176.9187 66 P 4.1944 0.0000 0.0000 66.0168 31.4311 178.4633 67 S 4.0572 7.9457 111.0196 61.0463 62.0199 176.0076 68 L 4.0467 7.5593 120.8583 57.1034 41.4718 178.6723 69 Q 4.1529 7.4740 117.1427 59.0672 29.1435 176.9868 70 T 4.1850 7.6331 109.4670 61.3741 70.0043 175.1208 71 G 4.0577 8.3539 113.0842 45.7400 0.0000 173.6023 72 S 4.2996 8.1359 114.4122 58.1889 63.1591 173.6379 73 E 4.7072 8.4879 123.2810 56.0209 30.4433 177.6441 74 E 4.0466 8.1046 122.5905 58.6506 29.8382 177.6821 75 L 4.7791 7.7285 116.1289 54.5141 42.6739 177.9891 76 R 3.9592 8.0634 120.8989 59.7107 29.9384 178.7948 77 S 4.2692 8.2280 113.6263 61.2623 62.8848 175.8267 78 L 4.4665 8.4102 123.4875 58.4379 41.9785 178.0149 79 Y 4.0663 8.4635 119.5400 60.9516 38.6873 178.1266 80 N 4.4492 8.5224 117.1980 56.7088 38.7747 177.4756 81 T 3.9842 8.9829 118.0101 66.9690 68.5951 176.6731 82 I 3.9033 8.2348 121.3138 63.7644 36.9669 178.3651 83 A 3.8482 7.7756 122.2058 54.8969 18.0960 179.6258 84 V 3.5138 7.7415 116.2970 66.1824 31.5829 178.1050 85 L 3.8500 8.0358 118.7045 58.2060 41.5736 179.0217 86 Y 4.1605 8.2503 119.1813 61.0568 38.6028 178.1772 87 C 3.9831 7.9128 117.6049 62.5741 28.1767 175.9501 88 V 3.5671 7.9111 119.9548 66.6234 30.8796 177.6438 89 H 4.6555 8.0285 115.8872 58.1222 28.6027 176.8180 90 Q 4.2100 7.4999 116.5466 55.0551 28.6350 176.2648 91 R 3.8327 7.7335 117.6920 56.9126 28.1556 175.9834 92 I 4.0851 7.6900 119.8515 60.1722 37.2063 175.7651 93 D 4.5509 8.5329 126.3492 54.3676 41.3077 176.4918 94 V 4.7829 7.9718 115.8083 60.2381 35.7786 174.8193 95 K 4.2791 10.7800 123.5581 57.9980 33.0177 176.0988 96 D 5.6861 7.5431 118.4373 51.7934 43.4132 175.8655 97 T 3.9608 7.9629 116.6396 67.0748 68.4473 176.6733 98 K 4.0765 8.0834 120.6045 59.3725 32.3469 178.0895 99 E 3.9259 9.0276 119.8848 59.2636 29.5069 178.6029 100 A 4.0241 7.9815 120.5351 55.4598 18.5437 179.6566 101 L 4.0536 8.4976 117.5591 57.9120 41.7217 179.7704 102 D 4.3422 8.1572 118.9882 57.2905 40.7431 178.6346 103 K 3.9689 8.1442 118.9708 59.8453 31.8459 179.4495 104 I 3.7873 7.8599 118.8392 64.2345 37.0319 177.6638 105 E 4.0310 8.4168 119.0534 60.0687 29.4847 179.1593 106 E 4.2106 8.1204 116.1158 58.3965 30.1633 176.4465 107 E 4.1598 7.8329 124.0514 56.7109 29.5007 176.4968 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 6 S 8.33 4.36 0.00 3.82 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 7 V 8.33 3.85 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 0.75 0.00 0.00 0.87 0.00 0.00 8 L 7.24 4.98 0.00 1.48 1.42 0.29 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.77 4.39 0.00 4.01 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 10 G 8.90 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 11 G 7.96 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 12 E 7.92 3.99 0.00 2.28 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 2.34 2.35 0.00 13 L 8.30 4.04 0.00 1.81 1.88 1.04 1.22 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 14 D 7.71 4.48 0.00 2.75 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 K 8.25 4.06 0.00 2.10 1.89 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.65 7.81 16 W 8.75 4.49 0.00 3.42 3.36 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 17 E 8.08 4.91 0.00 2.25 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 0.00 2.60 2.51 0.00 18 K 8.03 4.13 0.00 1.98 1.87 0.00 1.61 0.00 0.00 1.99 0.00 0.00 3.13 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.53 7.81 19 I 7.21 4.20 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.97 0.95 0.00 0.00 20 R 9.18 4.72 0.00 1.78 1.86 0.00 3.11 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 21 L 8.23 3.64 0.00 1.39 1.42 0.61 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.62 4.77 0.00 1.81 1.74 0.00 3.13 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 23 P 0.00 4.90 0.00 2.03 2.00 0.00 3.87 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 24 G 8.90 3.87 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 0.00 0.00 0.00 25 G 7.74 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 26 K 8.46 4.05 0.00 1.84 1.91 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.42 7.81 27 K 7.92 3.81 0.00 1.55 1.68 0.00 1.57 0.00 0.00 1.76 0.00 0.00 2.74 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.36 7.81 28 Q 8.35 4.88 0.00 1.83 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 29 Y 8.83 3.94 0.00 2.14 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 30 K 8.97 5.08 0.00 1.81 1.82 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.38 7.81 31 L 8.62 4.22 0.00 1.78 1.78 0.97 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.39 3.95 0.00 2.02 2.14 0.00 1.46 0.00 0.00 1.78 0.00 0.00 2.71 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.41 7.81 33 H 8.38 4.64 0.00 4.01 3.86 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.11 3.77 1.93 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.45 0.77 0.00 0.00 35 V 7.88 3.61 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 1.09 0.00 0.00 1.01 0.00 0.00 36 W 8.63 4.06 0.00 3.69 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 37 A 8.43 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 38 S 8.18 3.99 0.00 3.97 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 39 R 7.84 3.82 0.00 1.68 1.83 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 40 E 7.66 3.54 0.00 1.53 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 1.47 1.47 0.00 41 L 7.73 4.15 0.00 1.83 1.92 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.05 4.02 0.00 2.19 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 2.30 2.32 0.00 43 R 7.44 3.83 0.00 1.34 1.40 0.00 2.98 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 1.46 1.65 0.00 44 F 7.36 4.73 0.00 3.09 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 45 A 8.28 3.79 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 46 V 7.91 4.32 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 0.81 0.00 0.00 0.98 0.00 0.00 47 N 8.61 4.44 0.00 2.84 2.69 0.00 0.00 6.96 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 48 P 0.00 4.42 0.00 2.22 2.41 0.00 3.73 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 49 G 8.63 3.57 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 0.00 50 L 7.92 4.12 0.00 1.80 1.74 0.97 0.59 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 51 L 7.88 4.26 0.00 1.67 1.70 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.00 4.27 0.00 2.01 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 2.42 2.36 0.00 53 T 6.91 4.55 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 1.15 0.00 0.00 54 S 8.63 4.24 0.00 3.88 3.92 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 55 E 8.29 4.20 0.00 2.07 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 0.00 2.41 2.48 0.00 56 G 8.18 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 57 C 8.17 3.92 0.00 3.45 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 58 R 8.47 3.55 0.00 1.89 2.15 0.00 3.15 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.46 0.00 59 Q 8.23 3.94 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 60 I 7.94 3.77 1.97 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 0.50 0.92 0.00 0.00 61 L 8.15 4.07 0.00 1.68 1.62 0.46 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.87 3.75 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 0.00 0.00 0.00 63 Q 7.67 4.16 0.00 2.23 2.15 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 2.38 2.50 0.00 64 L 8.31 4.16 0.00 2.08 1.85 1.05 0.51 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 65 Q 8.04 3.76 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.50 0.00 66 P 0.00 4.19 0.00 2.15 2.08 0.00 3.66 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 2.09 2.14 0.00 67 S 7.95 4.06 0.00 3.83 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 68 L 7.56 4.05 0.00 1.62 1.52 -0.02 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 7.47 4.15 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 70 T 7.63 4.19 4.22 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 1.21 0.00 0.00 71 G 8.35 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.14 4.30 0.00 3.82 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 8.49 4.71 0.00 2.00 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 2.28 2.19 0.00 74 E 8.10 4.05 0.00 1.95 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 2.51 2.41 0.00 75 L 7.73 4.78 0.00 1.75 1.66 0.71 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.06 3.96 0.00 2.10 1.98 0.00 3.14 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 77 S 8.23 4.27 0.00 4.05 4.07 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 78 L 8.41 4.47 0.00 2.08 2.11 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.46 4.07 0.00 3.19 3.21 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 0.00 80 N 8.52 4.45 0.00 3.16 3.01 0.00 0.00 7.02 6.35 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 81 T 8.98 3.98 4.69 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 1.64 0.00 0.00 82 I 8.23 3.90 1.79 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 1.49 0.84 0.87 0.00 0.00 83 A 7.78 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.74 3.51 1.85 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 0.66 0.00 0.00 0.89 0.00 0.00 85 L 8.04 3.85 0.00 2.03 1.70 0.83 0.33 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 86 Y 8.25 4.16 0.00 3.10 3.19 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 0.00 0.00 0.00 0.00 87 C 7.91 3.98 0.00 3.13 3.13 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 88 V 7.91 3.57 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 1.13 0.00 0.00 1.08 0.00 0.00 89 H 8.03 4.66 0.00 3.14 3.25 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.50 4.21 0.00 1.69 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 1.78 1.35 0.00 91 R 7.73 3.83 0.00 1.92 2.02 0.00 3.30 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 92 I 7.69 4.09 1.93 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.44 0.92 0.00 0.00 93 D 8.53 4.55 0.00 2.67 2.61 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 94 V 7.97 4.78 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 0.75 0.00 0.00 0.93 0.00 0.00 95 K 10.78 4.28 0.00 1.98 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.41 7.81 96 D 7.54 5.69 0.00 2.94 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 97 T 7.96 3.96 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 1.32 0.00 0.00 98 K 8.08 4.08 0.00 1.84 1.99 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.52 7.81 99 E 9.03 3.93 0.00 2.25 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 2.33 2.35 0.00 100 A 7.98 4.02 1.42 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 0.00 0.00 101 L 8.50 4.05 0.00 1.83 1.84 1.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.16 4.34 0.00 2.89 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 3.97 0.00 1.91 1.95 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.58 7.81 104 I 7.86 3.79 1.89 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 1.30 0.33 0.89 0.00 0.00 105 E 8.42 4.03 0.00 2.21 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 0.00 2.50 2.54 0.00 106 E 8.12 4.21 0.00 2.16 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 0.00 2.32 2.60 0.00 107 E 7.83 4.16 0.00 1.97 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 2.41 2.53 0.00