NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.7170 8.1076 123.6076 52.5017 21.1824 178.9181 2 S 4.0007 8.2307 111.0441 61.5798 62.9068 174.8896 3 D 4.3944 8.2878 122.6143 56.2556 41.1035 179.6962 4 K 3.9574 8.0979 120.0240 59.4423 32.2717 178.4453 5 F 2.6576 8.1656 120.9875 60.7617 39.0066 176.7275 6 N 3.9085 7.9713 116.0226 56.2800 38.1043 177.3119 7 Q 3.8724 7.5734 118.0016 58.8601 29.2116 178.3664 8 F 4.1317 7.9153 121.4184 61.4582 39.3985 176.9389 9 I 3.1013 7.3960 118.4068 63.9373 37.4104 177.4190 10 N 4.3747 7.3825 115.7953 55.4966 38.3942 177.1571 11 R 3.9557 7.3869 119.0205 57.8939 30.2923 177.5021 12 V 3.9819 7.0626 108.6317 60.4148 33.4834 174.9025 13 L 4.5698 7.6503 122.6944 52.6809 43.2895 176.0789 14 S 4.3705 8.6031 120.3430 58.9132 62.9898 173.0597 15 H 5.0048 8.8403 120.0645 55.5739 28.7711 174.7461 16 E 4.5766 8.4327 119.2429 54.2016 31.2621 176.6614 17 G 2.0000 7.7915 111.9011 45.5421 0.0000 173.7498 18 G 3.9447 7.6426 106.8133 45.8753 0.0000 173.1008 19 Y 4.3514 7.8879 118.8340 57.9794 39.7118 175.5574 20 A 4.2105 8.3287 127.1877 50.1948 22.7132 174.5988 21 N 4.5813 8.2521 120.9929 52.8958 40.6185 174.8595 22 H 4.6724 8.6141 123.4428 54.1227 29.3996 171.3546 23 P 4.4857 0.0000 0.0000 60.6748 29.7108 175.3314 *27 G 4.0415 8.2823 112.4588 45.0318 0.0000 171.4428 28 G 4.0872 8.0805 104.6312 45.7220 0.0000 173.8425 29 E 4.3235 8.1899 122.6758 56.8838 30.9100 175.7343 30 T 5.2366 8.7747 122.5285 61.9193 73.0081 172.4493 31 N 5.0017 8.7421 123.0731 52.4102 42.9156 174.3507 32 W 3.5807 9.2957 124.3576 57.8830 27.2662 175.3811 33 G 4.0785 8.6697 104.1928 45.6177 0.0000 173.7052 34 I 4.4680 7.7836 120.8799 59.2394 39.6065 175.8455 35 T 4.7664 8.1933 115.4668 60.5047 71.4750 175.7968 36 K 4.0805 8.6474 124.3652 60.3383 32.1114 179.2171 37 R 4.1052 8.0484 120.8540 62.0450 29.0661 180.6192 38 T 4.1063 7.8179 115.1522 66.4110 68.8758 176.1510 39 A 4.2244 8.3872 122.8064 55.6742 18.2674 179.8726 40 Q 4.1601 8.7311 115.2727 58.8915 28.8253 178.5263 41 A 4.2181 8.6123 121.4263 53.9014 18.5603 177.3807 42 N 4.8896 8.1213 115.0905 53.0826 39.3704 175.9006 43 G 3.8382 8.6255 106.2106 45.5625 0.0000 173.6907 44 Y 4.3243 7.7491 120.5513 56.6577 37.9882 174.0314 45 N 4.6923 8.2597 123.3001 52.8080 39.1606 175.8991 46 G 3.7215 6.2327 108.5213 43.9996 0.0000 174.1396 47 S 4.3924 8.0700 114.2663 57.9740 63.8016 173.3669 *49 R 3.6350 8.5206 117.0869 56.3025 31.3182 176.1633 50 A 4.1756 7.6623 120.7543 51.3074 17.6418 177.0283 *52 T 4.2183 7.9596 111.8628 62.1196 71.2464 174.5875 53 R 2.0000 7.6362 120.6473 59.0791 29.7897 178.4594 54 E 3.8336 7.7303 117.8014 59.3278 29.5720 179.1460 55 Q 3.9218 7.8721 117.7577 58.6479 28.6257 178.4929 56 A 3.8595 7.7231 121.8651 55.2462 18.3818 179.6421 57 I 3.9456 7.9467 118.5266 64.8896 37.0755 178.6534 58 S 4.2168 8.2423 115.8584 61.8022 62.6575 177.0936 59 I 3.7583 7.6308 122.0146 64.6883 36.9103 178.0868 60 Y 4.5915 8.3391 117.8740 61.1325 37.6993 178.5214 61 R 2.9492 8.6310 120.1243 59.1444 29.9228 178.7843 62 K 4.1507 8.0551 119.1379 58.8746 32.0502 179.3312 63 A 3.8543 8.4543 119.7738 54.0791 18.5453 177.5843 64 F 5.0076 8.4524 117.0512 59.9696 41.1934 177.5334 65 W 3.8482 8.1728 126.8608 60.4743 30.3486 178.1048 66 E 3.8254 8.5513 118.9145 59.3441 28.7465 179.2805 67 R 3.5686 7.3292 117.4612 59.1791 30.0682 176.7877 68 Y 4.5671 7.4852 111.7726 56.8285 38.5253 175.7063 69 R 3.5033 7.4082 118.3968 57.1139 28.1715 178.0166 70 A 3.7307 6.9759 119.9290 54.1539 18.7286 179.4821 71 D 3.6236 6.3462 114.3398 55.3580 40.1247 177.1061 72 Q 4.1381 7.0517 121.3653 54.2137 27.7798 174.4050 *74 P 4.1601 0.0000 0.0000 61.8370 34.2561 176.8025 75 E 3.8044 8.7437 122.2079 59.7013 29.5896 179.2810 76 A 4.2617 8.0562 119.9810 55.0884 18.4154 179.6897 77 V 3.5170 7.7927 116.3224 66.1199 31.6935 178.0001 78 A 4.3902 8.3491 120.7595 55.1695 18.1573 179.6591 79 F 4.7437 8.7320 116.6747 61.2230 39.0711 177.9869 80 Q 4.2188 8.3240 117.2711 58.7564 28.4714 178.3563 81 F 4.4858 8.7795 122.2799 61.4026 39.4394 176.8258 82 F 3.4466 9.0101 120.6364 61.1889 39.1412 176.3774 83 D 4.2361 8.3415 117.3285 57.4878 41.0142 178.2114 84 A 4.0260 8.2421 121.0738 55.3244 18.3831 179.4169 85 C 4.0213 7.9638 115.3633 62.8659 27.8891 176.5582 86 V 3.2721 7.0040 118.6755 65.7312 31.1168 177.3214 87 N 4.4294 7.9553 115.8787 56.1314 38.9958 175.2104 88 H 4.8796 8.6000 114.6656 54.9132 30.9157 175.2597 89 G 4.0349 7.9127 106.9925 45.3855 0.0000 174.3696 90 Y 4.1765 8.8099 119.0639 61.0452 38.1430 179.4148 91 G 3.8087 8.3390 106.1113 47.7575 0.0000 175.3175 92 N 4.2123 8.1368 117.2334 56.1678 38.7377 176.9217 93 A 4.1999 7.9090 120.4424 54.9771 18.7799 179.1355 94 A 4.0720 8.5798 119.8168 55.1864 18.5585 180.9404 95 R 4.3157 7.8316 116.7504 56.1763 30.2777 178.8668 *97 L 4.4415 7.9436 121.9239 55.3648 44.2495 178.4883 98 Q 3.9857 8.2158 117.4042 59.0688 29.1127 178.8950 99 R 3.9130 8.4219 116.9116 59.2231 30.2723 179.0316 100 A 4.0148 7.9924 119.0633 54.8498 18.5112 177.8863 101 A 4.2115 8.0106 116.5328 52.0984 18.9549 177.2762 102 G 3.8654 7.9146 103.7435 46.8717 0.0000 174.1804 103 V 4.5334 7.5419 110.8133 57.8862 35.1249 174.3325 104 P 4.3136 0.0000 0.0000 63.2254 32.0305 177.4949 105 D 4.8720 8.3997 124.2097 52.1829 37.9764 175.9256 106 D 4.5688 7.9181 117.9734 53.6379 40.4819 178.4783 107 G 3.9538 8.7553 108.2995 45.7304 0.0000 173.5695 108 V 4.1955 8.2508 120.0134 61.0381 32.4368 175.5575 109 I 4.1682 8.4761 129.5481 60.1272 36.5137 174.6921 110 G 4.3336 7.9195 116.8130 43.2873 0.0000 170.8665 111 A 3.9064 8.7430 119.5989 55.4368 18.2953 180.3136 112 V 3.4838 7.6525 115.8875 66.2218 31.6686 178.1678 113 S 4.0895 7.9756 114.3552 61.7519 62.7314 176.6799 114 L 3.9022 8.0628 121.6796 57.4019 41.3111 179.2574 115 K 3.8105 8.4461 119.9171 59.5098 32.1672 178.7108 116 A 3.9807 7.7344 121.6802 54.7630 18.1368 179.4318 117 I 3.5805 7.7121 117.3929 64.8298 37.2503 177.9767 118 N 4.5218 8.1106 115.9490 55.4006 38.2815 177.1575 119 S 4.3328 7.9407 115.6197 59.5222 63.6116 174.6085 120 L 4.1840 7.0644 121.2378 53.2410 42.3289 175.5639 121 P 4.2452 0.0000 0.0000 63.0292 32.5175 177.1874 122 E 3.9375 8.8384 123.0313 59.6415 29.6410 178.7941 123 N 4.4455 8.1277 115.9291 56.0920 38.5979 176.9887 124 D 4.3457 8.0751 120.0559 57.2898 40.9238 178.2308 125 L 3.9619 7.9067 120.6765 58.4069 41.9965 179.1387 126 L 4.1221 8.0279 118.8186 57.4100 41.5485 179.0665 127 L 3.9751 8.2134 120.6235 58.4487 42.0008 179.3988 128 R 3.9817 8.2312 117.9477 59.1680 29.8917 178.8562 129 F 4.2595 8.5873 120.8776 61.4793 39.3342 177.0272 130 N 4.1851 8.6753 116.1362 55.9852 38.2891 177.2620 131 A 4.0057 8.1744 122.3745 55.2414 18.4896 179.5712 132 E 3.9501 8.5683 117.4855 59.4820 29.5186 179.7717 133 R 3.8531 7.9353 118.4131 59.1940 30.2660 179.0666 134 L 4.3706 8.2783 119.2365 58.0469 41.4807 180.1040 135 V 3.7629 7.7473 117.7014 64.4398 31.1877 178.0510 136 F 4.2113 8.4203 121.4577 61.4279 39.3334 176.4897 137 Y 3.7241 8.2827 119.2798 60.2895 38.3849 177.4098 138 T 3.8175 7.6142 109.1195 63.9670 68.9493 175.0615 139 K 4.2374 7.1827 118.9313 57.2223 33.0839 177.7337 140 L 3.8527 7.5406 120.2433 57.1162 41.7146 176.4539 141 G 3.8224 7.0649 104.6889 45.2803 0.0000 172.4681 142 T 4.0650 7.5639 113.3999 61.0305 68.2109 175.3163 143 F 2.0000 8.4721 121.3456 59.3131 37.9032 177.3048 144 T 3.6962 6.3972 109.7267 63.1042 68.6396 174.9281 145 S 4.3262 7.3547 116.0407 58.9810 63.7164 174.6480 146 F 4.6476 7.6379 120.3518 57.0192 39.5654 175.3295 147 G 3.9600 9.3535 112.1654 45.3653 0.0000 173.1736 148 K 4.1894 8.7250 122.5034 57.3885 32.6165 176.8243 149 G 4.0359 9.2195 113.4407 46.5006 0.0000 174.8579 150 W 3.9020 8.3548 130.4485 60.3169 30.6320 178.3020 151 V 3.8910 8.3008 117.7258 66.0476 31.0346 177.6188 152 R 3.8857 8.1127 117.9724 59.6463 29.9621 178.5495 153 R 3.9382 7.9232 117.7484 59.2068 30.0189 179.2847 154 V 3.2994 7.3928 117.8646 65.5777 31.4261 177.8446 155 A 3.9886 8.5251 120.9368 55.4239 18.1743 179.6804 156 Q 3.9620 8.2565 116.5742 59.1403 28.7429 178.6742 157 N 4.3656 8.2232 117.5338 56.3324 38.3089 177.4666 158 L 4.0407 7.7637 119.5561 57.8661 41.5229 179.3188 159 I 3.9021 7.8034 119.8744 64.4130 36.7817 178.0174 160 H 4.1715 8.5029 118.7677 59.0529 29.8828 176.7018 161 A 4.2339 7.9334 119.9208 53.2471 18.8305 177.9219 162 S 4.6715 7.4403 113.5933 57.3045 63.2306 174.0321 163 A 4.1344 7.6066 128.9462 52.7958 18.8071 176.7686 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 8.11 4.72 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 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.23 4.00 0.00 4.19 4.19 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 3 D 8.29 4.39 0.00 2.81 2.76 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 4 K 8.10 3.96 0.00 1.98 2.32 0.00 1.88 0.00 0.00 2.09 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.88 1.67 7.81 5 F 8.17 2.66 0.00 1.51 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 6 N 7.97 3.91 0.00 2.68 2.73 0.00 0.00 7.06 6.63 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 7 Q 7.57 3.87 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 8 F 7.92 4.13 0.00 3.04 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 9 I 7.40 3.10 0.57 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.84 0.42 0.00 0.00 10 N 7.38 4.37 0.00 2.52 2.76 0.00 0.00 7.09 8.59 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 11 R 7.39 3.96 0.00 1.81 1.63 0.00 3.17 0.00 0.00 3.50 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 12 V 7.06 3.98 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 -0.26 0.00 0.00 13 L 7.65 4.57 0.00 1.29 1.48 1.18 0.87 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 14 S 8.60 4.37 0.00 3.90 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 15 H 8.84 5.00 0.00 3.22 3.46 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.43 4.58 0.00 1.89 1.88 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 2.22 2.18 0.00 17 G 7.79 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 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.64 3.94 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 0.00 19 Y 7.89 4.35 0.00 3.02 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 20 A 8.33 4.21 0.92 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 21 N 8.25 4.58 0.00 2.78 2.69 0.00 0.00 6.92 7.89 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 22 H 8.61 4.67 0.00 3.11 3.15 0.00 5.75 0.00 0.00 0.00 0.00 6.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.49 0.00 2.09 1.87 0.00 3.77 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 1.92 1.58 0.00 *27 G 8.28 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 28 G 8.08 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 29 E 8.19 4.32 0.00 2.11 1.91 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 2.42 2.48 0.00 30 T 8.77 5.24 4.18 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 1.26 0.00 0.00 31 N 8.74 5.00 0.00 3.00 2.85 0.00 0.00 7.03 8.00 0.00 0.00 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 W 9.30 3.58 0.00 3.57 3.48 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 33 G 8.67 4.08 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 0.00 0.00 0.00 34 I 7.78 4.47 2.01 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.84 0.89 0.00 0.00 35 T 8.19 4.77 4.47 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 0.00 0.00 0.00 1.24 0.00 0.00 36 K 8.65 4.08 0.00 1.95 2.02 0.00 1.90 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.67 1.58 7.81 37 R 8.05 4.11 0.00 1.88 1.94 0.00 3.34 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 1.57 1.56 0.00 38 T 7.82 4.11 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 1.37 0.00 0.00 39 A 8.39 4.22 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 40 Q 8.73 4.16 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 41 A 8.61 4.22 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 42 N 8.12 4.89 0.00 2.77 2.80 0.00 0.00 7.09 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 43 G 8.63 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 44 Y 7.75 4.32 0.00 2.93 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 45 N 8.26 4.69 0.00 2.89 2.74 0.00 0.00 7.10 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 46 G 6.23 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 47 S 8.07 4.39 0.00 4.04 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 *49 R 8.52 3.64 0.00 1.09 1.80 0.00 2.81 0.00 0.00 2.99 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.68 0.00 50 A 7.66 4.18 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 *52 T 7.96 4.22 4.15 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 0.00 0.00 1.25 0.00 0.00 53 R 7.64 2.00 0.00 0.67 1.41 0.00 3.01 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.87 0.00 54 E 7.73 3.83 0.00 1.93 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 2.28 2.28 0.00 55 Q 7.87 3.92 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 56 A 7.72 3.86 1.21 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 0.00 0.00 57 I 7.95 3.95 2.04 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.68 1.06 0.00 0.00 58 S 8.24 4.22 0.00 4.06 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 59 I 7.63 3.76 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.63 0.82 0.00 0.00 60 Y 8.34 4.59 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 129 F 8.59 4.26 0.00 3.19 3.27 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 0.00 130 N 8.68 4.19 0.00 2.86 2.80 0.00 0.00 6.92 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 0.00 131 A 8.17 4.01 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 0.00 132 E 8.57 3.95 0.00 1.99 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 2.58 2.52 0.00 133 R 7.94 3.85 0.00 1.87 2.07 0.00 2.93 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.90 0.00 134 L 8.28 4.37 0.00 1.99 1.84 0.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.75 3.76 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 0.86 0.00 0.00 0.97 0.00 0.00 136 F 8.42 4.21 0.00 3.22 3.28 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 0.00 137 Y 8.28 3.72 0.00 2.98 2.48 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 0.00 138 T 7.61 3.82 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 0.00 139 K 7.18 4.24 0.00 1.66 1.90 0.00 1.45 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.16 7.81 140 L 7.54 3.85 0.00 1.36 1.51 0.65 0.43 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 0.00 141 G 7.06 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 0.00 142 T 7.56 4.06 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 0.97 0.00 0.00 143 F 8.47 2.00 0.00 2.81 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 0.00 144 T 6.40 3.70 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 0.50 0.00 0.00 145 S 7.35 4.33 0.00 3.91 3.86 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 0.00 0.00 0.00 146 F 7.64 4.65 0.00 3.23 3.09 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 0.00 147 G 9.35 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 0.00 148 K 8.72 4.19 0.00 1.80 1.82 0.00 1.94 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.50 7.81 149 G 9.22 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 0.00 150 W 8.35 3.90 0.00 3.59 3.26 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 0.00 151 V 8.30 3.89 2.38 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 1.14 0.00 0.00 1.42 0.00 0.00 152 R 8.11 3.89 0.00 1.96 2.09 0.00 3.26 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 153 R 7.92 3.94 0.00 1.76 1.72 0.00 3.06 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 154 V 7.39 3.30 1.78 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 0.87 0.00 0.00 -0.51 0.00 0.00 155 A 8.53 3.99 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 0.00 156 Q 8.26 3.96 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 157 N 8.22 4.37 0.00 2.91 2.87 0.00 0.00 7.03 6.15 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 0.00 158 L 7.76 4.04 0.00 1.86 1.74 0.93 0.72 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 0.00 159 I 7.80 3.90 2.01 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 1.41 1.21 0.92 0.00 0.00 160 H 8.50 4.17 0.00 3.20 3.34 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 7.93 4.23 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 0.00 0.00 162 S 7.44 4.67 0.00 4.02 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 0.00 163 A 7.61 4.13 1.15 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 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.