NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3708 8.2649 123.5941 52.0844 19.9447 175.6658 2 N 4.7304 8.6028 116.6332 50.9634 40.5458 172.7668 3 A 4.8119 8.4476 125.2325 49.3255 23.1845 174.8314 4 F 3.9488 8.7226 121.2507 59.7233 39.5115 170.7439 5 L 3.3123 7.8716 135.0000 54.1872 40.7707 174.3497 *8 L 4.2720 8.3939 122.8486 54.3774 43.6418 177.6742 9 R 4.2811 7.6348 116.2616 54.5161 31.0336 174.5695 10 P 4.3792 0.0000 0.0000 62.0007 32.0381 176.9261 11 G 3.6484 8.2076 109.7570 45.9737 0.0000 173.4067 12 S 4.2616 8.0653 115.4858 56.4503 64.9913 174.4198 13 L 3.6616 8.4058 127.0118 56.3406 41.3909 177.6865 *15 R 4.0249 7.9066 114.3906 56.0339 31.2848 176.4300 *17 C 4.9362 8.0737 114.1008 57.0277 42.1372 173.9704 18 K 4.4302 7.8358 118.6071 56.4757 32.0483 176.8415 *21 Q 4.3956 7.9169 116.5845 55.9342 30.0654 174.0074 22 C 5.1582 9.1208 116.9932 53.4314 44.0371 174.0124 23 S 4.8120 8.4663 116.4967 57.3245 64.1791 174.1217 24 F 2.7769 8.2546 123.4548 58.0801 37.1509 174.6738 *27 A 4.1285 8.0259 127.0592 51.6873 20.6957 180.8422 28 R 4.3890 7.2646 117.3574 55.4476 29.2015 178.7607 *30 I 3.8420 7.9032 117.4141 61.1452 38.8674 177.7238 31 F 4.0856 8.0042 116.8936 58.2024 38.8941 176.0260 32 K 4.1834 8.1513 123.6082 57.2799 31.2341 175.9150 33 D 4.4908 7.5550 117.2189 53.9193 42.0390 176.7972 34 A 4.1686 8.4351 124.3359 53.3615 18.3014 179.5464 *36 R 4.2242 8.0566 119.5617 57.9014 32.1877 178.2991 37 T 3.5526 7.7908 114.0745 66.3987 68.4055 176.8488 38 K 4.2311 8.3800 120.6749 59.5540 31.8816 179.1192 39 L 3.9953 7.8302 118.9506 58.1069 42.5246 178.3192 40 F 4.2128 8.0309 120.5644 60.8458 39.1772 176.8401 41 W 4.3526 8.8752 128.5342 60.5779 30.4309 177.5244 42 I 3.7061 7.7280 119.5247 65.0920 36.4073 178.4688 43 S 4.0629 7.7282 113.6570 61.4208 62.8848 175.1847 44 Y 3.8445 7.1782 121.8318 60.3131 38.5374 177.1290 45 S 3.6239 7.7987 113.2260 59.8691 63.2969 174.6746 46 D 4.1857 7.5029 121.5156 56.3356 40.9386 177.6975 47 G 3.7091 7.9301 101.2463 45.6574 0.0000 172.7811 48 D 4.7527 8.0133 119.4007 52.2294 40.0316 176.9422 49 Q 4.0220 8.7391 125.3009 58.1038 29.1360 177.2824 50 C 4.3185 8.1993 114.1964 57.0484 40.7359 175.1383 51 A 3.8538 8.0671 124.5803 55.1611 17.9497 179.2459 52 S 4.1046 7.8725 107.8308 58.9127 63.9153 173.8067 53 S 3.6832 7.5668 117.0844 59.1900 60.1402 170.9117 54 P 4.1622 0.0000 0.0000 65.4944 31.7894 177.9638 55 C 4.5079 7.8588 116.5278 56.6286 36.3191 173.3969 56 Q 4.1792 8.9205 125.6086 55.3148 29.9244 175.3825 57 N 3.5649 9.4886 112.8361 54.5088 35.9034 175.1198 58 G 3.7294 8.2781 102.0512 46.0719 0.0000 174.5969 59 G 4.0117 7.6122 106.1505 45.3975 0.0000 173.8915 60 S 4.9675 9.0499 116.8471 56.7578 65.3318 172.6824 61 C 5.3686 8.7635 124.0577 55.1016 43.1992 172.5268 62 K 4.7010 8.9502 126.0018 54.4621 34.6248 174.9511 63 D 4.9023 8.8953 127.2964 54.7206 42.2169 174.9166 64 Q 4.4829 8.4696 121.8965 54.2399 33.0172 174.5059 65 L 4.3109 8.2811 118.2864 54.8958 40.8989 176.7973 66 Q 3.5807 8.7486 123.2204 56.5092 26.7917 173.8143 67 S 4.5685 7.5860 111.4061 59.0150 65.3800 173.4112 68 Y 5.1606 7.5176 117.4251 56.7633 40.8774 173.7328 69 I 4.6412 8.8668 119.1288 59.7572 41.5144 174.0022 70 C 5.5825 8.8224 122.9992 55.3332 41.5971 173.0984 71 F 4.6294 9.5817 123.2016 56.2711 40.2159 174.7450 72 C 5.1372 8.7321 121.2061 55.1913 40.2664 173.8940 73 L 4.4341 8.4894 120.2583 53.9092 42.1424 176.5665 74 P 4.1418 0.0000 0.0000 65.9079 31.4881 177.0560 75 A 4.4006 7.9689 118.8333 51.7297 18.7092 176.1056 76 F 5.3372 7.9641 116.0838 57.2092 42.9603 173.6131 77 E 4.5890 9.2026 119.6042 55.2402 32.7521 173.9903 78 G 4.2985 8.9203 105.1025 44.0972 0.0000 174.7643 79 R 3.8846 8.6392 119.7304 58.7469 30.1522 177.0370 80 N 5.0360 8.4478 113.8734 52.7713 39.2853 173.9436 81 C 4.4745 8.1257 113.2413 57.9711 38.3221 174.5435 82 E 3.8854 8.3376 118.3669 58.3706 30.0011 176.5390 83 T 4.4358 8.2940 118.4613 62.5593 69.7899 173.3588 84 H 4.7970 8.8108 123.9135 54.2720 29.5813 176.3144 85 K 3.9672 8.5685 125.5471 59.5266 32.1024 179.3136 86 D 4.3721 7.8211 117.3336 57.0236 40.8723 176.6853 87 D 4.6514 7.8227 116.4077 55.0173 40.7989 176.4686 88 Q 4.5451 7.5696 117.7288 55.8148 29.4140 176.8633 89 L 4.3239 7.7286 120.4365 53.9619 40.7292 175.2339 90 I 4.6536 7.0085 114.9173 58.5125 41.3078 178.1585 91 C 4.3966 9.0666 119.1571 60.1195 40.0853 176.7665 92 V 3.3911 7.7473 117.3302 63.2829 31.4239 175.6087 93 N 4.5532 8.1318 120.5382 52.6487 37.9778 174.2037 94 E 3.9616 9.2353 128.5214 57.4766 27.4730 174.8341 95 N 4.7853 8.2783 109.9759 53.6627 37.6112 174.4229 96 G 4.0434 9.0063 101.2260 45.6332 0.0000 175.6828 97 G 3.9213 8.2130 106.1020 45.3394 0.0000 173.8040 98 C 4.4892 8.0754 117.8494 56.3015 40.8666 173.6785 99 E 4.0157 8.9950 125.7295 58.4516 30.8786 177.1780 100 Q 4.1574 8.2144 111.9533 56.1928 30.9417 177.1420 101 Y 4.8660 5.3700 121.9108 58.2071 40.4834 174.7057 102 C 5.4138 8.8406 122.0355 54.9137 46.9321 173.0831 103 S 4.7555 9.2558 121.4130 56.7432 65.5251 173.3429 104 D 4.8372 8.6726 124.7449 54.3528 41.7497 175.9305 105 H 4.8768 8.3963 117.9033 54.3892 32.6327 173.0418 106 T 4.2952 8.5226 114.9131 62.3896 69.6936 174.9081 107 G 3.9829 10.2865 112.6523 45.7716 0.0000 172.4190 108 T 4.5649 6.9022 111.6329 60.1541 70.7783 172.7326 109 K 4.1430 8.3379 124.5994 56.0312 32.6797 176.2403 110 R 4.5119 8.2792 120.2236 56.1623 30.7326 175.5320 111 S 4.8948 9.0075 114.2038 56.8838 66.3794 172.3030 112 C 5.3983 8.7575 118.2813 55.9044 43.0870 172.9446 113 R 4.9091 8.9254 119.4747 55.0794 34.8147 173.1745 114 C 5.1898 8.5962 116.5256 55.1116 44.7063 173.7028 115 H 4.6612 9.1356 120.2931 55.4048 30.1855 174.5895 116 E 4.2514 8.4764 123.5615 58.5949 29.8881 177.8239 117 G 4.0043 9.5185 110.6624 45.0532 0.0000 172.2153 118 Y 5.3686 7.8419 115.8247 56.1797 41.9769 175.0652 119 S 4.8097 8.9638 114.7521 56.2889 66.9803 173.0394 120 L 4.5314 8.5394 124.2321 55.3501 42.8913 176.7707 121 L 4.4524 8.8510 126.4762 53.6600 43.1297 177.7456 122 A 4.0077 8.6797 122.4551 55.5339 18.2406 178.3736 123 D 4.4712 8.1887 112.8950 53.5167 39.4212 178.0168 124 G 4.0417 8.0512 106.9457 46.4243 0.0000 174.8242 125 V 4.3375 7.7207 111.2040 62.0820 35.1712 176.3819 126 S 4.9165 8.6496 115.7421 58.1413 64.4168 172.9627 127 C 5.5807 8.5698 117.4559 55.6423 44.8489 173.5789 128 T 4.9201 8.6266 114.6441 59.7263 70.9123 171.2733 129 P 4.4078 0.0000 0.0000 62.9391 31.3033 176.2489 130 T 4.2970 8.7912 114.5956 62.2159 70.2754 175.3084 131 V 4.2292 7.3322 114.2661 59.1956 33.9147 175.4014 132 E 3.8609 8.5324 121.5664 58.7675 29.6148 176.3207 133 Y 4.6685 7.3380 115.6826 54.9668 38.2779 173.1094 134 P 4.4148 0.0000 0.0000 61.8265 32.5281 177.0907 135 C 4.2942 8.5678 114.3462 59.1864 30.2356 174.0034 136 G 4.1112 8.8365 107.3773 46.1226 0.0000 173.4754 137 K 4.5946 7.5507 117.5947 54.3107 35.2077 176.6086 138 I 4.2679 8.0324 123.4752 59.0095 36.9971 174.5379 139 P 4.2804 0.0000 0.0000 65.6551 31.2477 178.7503 140 I 4.0013 7.8308 107.4062 62.1913 37.4305 175.9615 141 L 4.6233 7.9606 120.0953 54.9040 43.5139 176.2849 142 E 4.1694 7.9648 122.8626 56.5403 29.3769 176.3973 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 A 8.26 4.37 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 2 N 8.60 4.73 0.00 2.80 2.75 0.00 0.00 6.64 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 8.45 4.81 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 4 F 8.72 3.95 0.00 2.98 3.03 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 5 L 7.87 3.31 0.00 1.48 1.46 0.75 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 8.39 4.27 0.00 1.76 1.71 0.78 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.63 4.28 0.00 1.75 1.81 0.00 3.18 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 10 P 0.00 4.38 0.00 1.98 1.92 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.03 0.00 11 G 8.21 3.65 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 0.00 0.00 0.00 12 S 8.07 4.26 0.00 3.71 3.65 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 13 L 8.41 3.66 0.00 1.42 1.47 0.24 0.84 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 *15 R 7.91 4.02 0.00 1.82 1.93 0.00 3.31 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.07 4.94 0.00 3.19 3.05 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 18 K 7.84 4.43 0.00 1.83 1.90 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.52 7.81 *21 Q 7.92 4.40 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 22 C 9.12 5.16 0.00 3.15 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 23 S 8.47 4.81 0.00 4.11 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 24 F 8.25 2.78 0.00 2.29 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 *27 A 8.03 4.13 1.28 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 0.00 0.00 28 R 7.26 4.39 0.00 1.37 1.70 0.00 3.18 0.00 0.00 3.29 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 *30 I 7.90 3.84 1.46 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.45 0.26 0.00 0.00 31 F 8.00 4.09 0.00 2.91 3.02 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 32 K 8.15 4.18 0.00 1.91 1.94 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.46 7.81 33 D 7.56 4.49 0.00 2.77 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 34 A 8.44 4.17 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 *36 R 8.06 4.22 0.00 1.94 2.02 0.00 3.22 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 37 T 7.79 3.55 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 0.54 0.00 0.00 38 K 8.38 4.23 0.00 1.94 1.98 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.75 7.81 39 L 7.83 4.00 0.00 1.63 1.84 0.94 0.69 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 40 F 8.03 4.21 0.00 2.52 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 41 W 8.88 4.35 0.00 3.75 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 42 I 7.73 3.71 1.85 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 1.58 1.57 0.90 0.00 0.00 43 S 7.73 4.06 0.00 3.72 3.83 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 44 Y 7.18 3.84 0.00 1.94 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 0.00 0.00 0.00 0.00 45 S 7.80 3.62 0.00 3.32 2.63 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 46 D 7.50 4.19 0.00 2.85 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 47 G 7.93 3.71 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 0.00 0.00 0.00 48 D 8.01 4.75 0.00 2.69 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 Q 8.74 4.02 0.00 2.33 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.74 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 50 C 8.20 4.32 0.00 3.13 3.03 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 51 A 8.07 3.85 1.25 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 0.00 0.00 0.00 52 S 7.87 4.10 0.00 3.89 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 53 S 7.57 3.68 0.00 3.98 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 54 P 0.00 4.16 0.00 1.84 1.80 0.00 3.48 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.69 0.00 55 C 7.86 4.51 0.00 2.97 3.11 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 0.00 56 Q 8.92 4.18 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.16 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 57 N 9.49 3.56 0.00 1.73 1.42 0.00 0.00 6.90 7.65 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 58 G 8.28 3.73 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 0.00 0.00 0.00 59 G 7.61 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 60 S 9.05 4.97 0.00 3.78 3.73 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 61 C 8.76 5.37 0.00 2.95 2.95 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 62 K 8.95 4.70 0.00 2.12 1.89 0.00 1.54 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.46 7.81 63 D 8.90 4.90 0.00 2.88 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 64 Q 8.47 4.48 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 65 L 8.28 4.31 0.00 1.62 1.62 0.90 1.10 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 66 Q 8.75 3.58 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 67 S 7.59 4.57 0.00 3.76 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 68 Y 7.52 5.16 0.00 3.08 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 69 I 8.87 4.64 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.95 0.50 0.00 0.00 70 C 8.82 5.58 0.00 2.99 3.05 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 71 F 9.58 4.63 0.00 2.98 3.04 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 72 C 8.73 5.14 0.00 2.94 3.12 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 73 L 8.49 4.43 0.00 2.01 1.77 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.14 0.00 2.06 2.18 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 75 A 7.97 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.96 5.34 0.00 3.01 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 77 E 9.20 4.59 0.00 2.13 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 2.22 2.28 0.00 78 G 8.92 4.30 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 0.00 79 R 8.64 3.88 0.00 1.75 2.00 0.00 3.19 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 80 N 8.45 5.04 0.00 2.84 3.01 0.00 0.00 6.99 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 81 C 8.13 4.47 0.00 3.19 3.10 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 82 E 8.34 3.89 0.00 2.12 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 2.32 2.31 0.00 83 T 8.29 4.44 4.44 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 1.25 0.00 0.00 84 H 8.81 4.80 0.00 3.31 3.16 0.00 5.82 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 85 K 8.57 3.97 0.00 1.76 1.79 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.35 7.81 86 D 7.82 4.37 0.00 2.58 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 87 D 7.82 4.65 0.00 2.84 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 88 Q 7.57 4.55 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.50 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 89 L 7.73 4.32 0.00 1.57 1.60 0.96 1.00 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 90 I 7.01 4.65 1.86 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 0.75 0.91 0.00 0.00 91 C 9.07 4.40 0.00 3.15 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 92 V 7.75 3.39 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 0.68 0.00 0.00 0.93 0.00 0.00 93 N 8.13 4.55 0.00 2.82 2.98 0.00 0.00 7.15 6.93 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 94 E 9.24 3.96 0.00 2.14 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 2.30 2.21 0.00 95 N 8.28 4.79 0.00 2.94 2.81 0.00 0.00 7.56 7.90 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 96 G 9.01 4.04 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 97 G 8.21 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 0.00 0.00 0.00 98 C 8.08 4.49 0.00 3.05 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 99 E 8.99 4.02 0.00 1.92 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 2.21 2.22 0.00 100 Q 8.21 4.16 0.00 1.70 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.68 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 101 Y 5.37 4.87 0.00 3.05 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 0.00 102 C 8.84 5.41 0.00 3.04 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 0.00 103 S 9.26 4.76 0.00 3.80 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 0.00 104 D 8.67 4.84 0.00 2.52 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 0.00 105 H 8.40 4.88 0.00 3.25 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.52 4.30 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 0.00 107 G 10.29 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 108 T 6.90 4.56 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 1.21 0.00 0.00 109 K 8.34 4.14 0.00 1.76 1.71 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.44 7.81 110 R 8.28 4.51 0.00 1.99 1.91 0.00 3.08 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 111 S 9.01 4.89 0.00 3.91 4.04 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 0.00 112 C 8.76 5.40 0.00 3.05 3.03 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 0.00 113 R 8.93 4.91 0.00 1.88 1.90 0.00 3.12 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 114 C 8.60 5.19 0.00 2.84 2.99 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 0.00 115 H 9.14 4.66 0.00 2.85 3.05 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.48 4.25 0.00 2.03 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 0.00 2.34 2.42 0.00 117 G 9.52 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 0.00 0.00 0.00 118 Y 7.84 5.37 0.00 2.91 2.81 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 0.00 119 S 8.96 4.81 0.00 3.86 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 0.00 120 L 8.54 4.53 0.00 1.68 1.63 0.97 1.04 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 0.00 121 L 8.85 4.45 0.00 1.77 1.60 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.68 4.01 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 0.00 123 D 8.19 4.47 0.00 2.84 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 0.00 124 G 8.05 4.04 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 0.00 125 V 7.72 4.34 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 0.76 0.00 0.00 1.00 0.00 0.00 126 S 8.65 4.92 0.00 3.86 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 0.00 127 C 8.57 5.58 0.00 2.88 2.99 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 0.00 128 T 8.63 4.92 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 1.22 0.00 0.00 129 P 0.00 4.41 0.00 1.80 1.58 0.00 3.68 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 1.96 1.99 0.00 130 T 8.79 4.30 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 1.19 0.00 0.00 131 V 7.33 4.23 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 0.67 0.00 0.00 0.82 0.00 0.00 132 E 8.53 3.86 0.00 1.77 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 1.47 2.02 0.00 133 Y 7.34 4.67 0.00 2.97 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.41 0.00 1.68 1.52 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.73 0.00 135 C 8.57 4.29 0.00 3.17 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 0.00 136 G 8.84 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 0.00 0.00 0.00 0.00 137 K 7.55 4.59 0.00 1.79 1.73 0.00 1.90 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.62 7.81 138 I 8.03 4.27 1.89 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 1.43 0.78 0.93 0.00 0.00 139 P 0.00 4.28 0.00 2.29 2.38 0.00 3.66 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 140 I 7.83 4.00 1.89 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 1.43 0.54 0.93 0.00 0.00 141 L 7.96 4.62 0.00 1.76 1.73 0.93 1.21 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 0.00 142 E 7.96 4.17 0.00 2.11 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 2.58 2.41 0.00 * Residues marked with a * may have inaccurate shift predictions.