NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 K 4.2447 8.3144 120.1302 56.2485 33.5298 174.9862 11 S 4.3341 8.3164 117.3639 55.5970 63.1541 172.6564 12 K 4.0016 9.0143 125.8405 57.7803 33.6543 176.2525 13 F 5.0146 7.9146 119.9833 56.1595 40.5919 175.9824 14 R 4.2899 9.2620 125.3403 58.7422 31.3595 177.0453 15 R 5.1626 8.1027 116.3712 54.5543 34.8558 174.2414 16 I 4.5078 8.4690 123.7686 59.4925 40.2262 174.0900 17 C 4.7385 8.2817 127.4763 58.2942 32.9107 172.1434 18 V 4.6009 8.4225 126.8580 61.1875 32.9182 174.6059 19 F 5.2695 8.6528 127.7264 56.5809 40.7408 174.7676 20 C 5.0100 8.5830 115.6273 57.1591 32.1550 173.7132 21 G 3.8922 8.2726 107.9977 46.7168 0.0000 174.8167 22 S 4.4892 8.9493 117.5396 59.3881 63.8607 173.8601 23 S 4.6100 7.6435 115.4357 57.1036 63.5518 173.6578 24 Q 4.0257 8.5429 123.4324 56.5685 28.9674 177.2865 25 G 4.0308 7.6914 102.8373 45.2448 0.0000 173.1964 26 K 4.3011 8.4136 116.1513 56.5400 32.9695 177.2124 27 K 4.4557 7.6274 118.7874 54.2786 33.9967 177.2835 28 S 4.3197 8.7219 118.6265 60.7936 62.2656 176.5614 29 S 4.0558 7.7604 116.7383 61.6152 62.7303 176.0507 30 Y 4.3314 7.2381 120.3466 60.9337 37.6435 178.2141 31 Q 4.0605 8.0191 118.6468 59.0314 28.9160 178.2198 32 D 4.4603 8.5700 120.1887 57.1421 40.7935 178.5960 33 A 4.0414 8.3004 121.2976 54.9987 18.3164 179.5340 34 A 3.9217 7.9579 118.9658 55.2440 18.4527 180.0178 35 V 3.4949 7.6222 116.2229 66.3572 31.5729 177.9038 36 D 4.3847 8.4812 119.0291 57.2587 40.5601 178.6645 37 L 4.0114 8.5115 121.3516 57.9618 42.1408 178.9281 38 G 3.7481 8.1484 105.8115 48.3148 0.0000 175.3577 39 N 4.3924 8.5645 119.6677 55.5219 38.4535 177.2476 40 E 3.9038 8.3707 121.1210 59.2201 29.7453 178.7788 41 L 3.9488 8.0473 119.1142 57.8036 41.7234 179.6556 42 V 3.5706 7.6973 118.2034 66.1519 31.2866 178.2223 43 S 4.1943 8.1346 112.5684 60.8902 62.7216 175.6120 44 R 4.3968 7.5828 118.8982 54.8043 30.3473 175.6762 45 N 4.2271 8.0364 114.9161 54.5845 36.5182 173.9388 46 I 4.5421 7.9879 118.1248 59.8781 39.3143 176.1788 47 D 4.7806 8.8217 126.0900 53.5590 43.0949 174.8184 48 L 5.0758 8.5610 122.2777 53.4246 44.5613 175.0741 49 V 5.0631 8.6949 126.5101 61.5606 34.0650 174.0676 50 Y 5.1856 9.1272 124.8421 55.9388 41.8299 175.3518 51 G 3.6800 8.7919 106.3670 45.6228 0.0000 174.4052 52 G 3.1282 5.3800 105.6499 45.3057 0.0000 173.5274 53 G 3.9475 8.4528 106.9785 45.1484 0.0000 173.4961 54 S 4.7292 8.3670 109.4968 57.5134 63.9441 173.6886 55 I 4.2642 7.7248 114.3944 60.7439 39.8553 177.6510 56 G 3.9540 8.3427 108.4246 45.7739 0.0000 175.7388 57 L 4.6280 7.9116 116.7033 54.6036 41.1550 179.5273 *59 G 4.1798 8.1304 108.2708 45.8479 0.0000 175.8073 60 L 3.9511 7.8667 120.1202 57.4253 41.5695 180.0189 61 V 3.6859 8.0262 119.6906 64.8782 31.2242 178.5886 62 S 3.7261 7.6184 114.7084 60.6716 62.8077 175.8985 63 Q 3.8665 8.1007 123.0311 58.8661 28.8644 178.1352 64 A 3.9462 7.8023 121.5745 55.2468 18.4206 179.8040 65 V 3.4645 7.8336 116.6532 66.2660 31.5704 177.6408 66 H 4.2040 8.3879 118.1936 59.6143 29.5433 177.0255 67 D 4.4586 8.2890 119.5364 56.9813 40.7053 178.2372 68 G 3.8489 7.8086 103.7924 45.1149 0.0000 174.4417 69 G 3.9073 8.0562 109.4513 45.0037 0.0000 173.8292 70 R 4.4362 7.2142 117.8127 55.2165 31.8146 175.6409 71 H 4.6163 8.8839 120.5711 56.0031 31.4226 174.0728 72 V 4.8532 8.0773 123.7473 61.1014 34.7264 173.8070 73 I 4.8819 9.0452 128.8735 59.5249 39.9666 174.5247 74 G 4.1236 9.3562 115.3056 44.4783 0.0000 172.0986 75 I 5.0620 8.4219 127.1619 59.5019 39.0199 175.2617 76 I 4.7612 8.9853 120.9522 58.1925 40.9406 173.0927 77 P 4.3995 0.0000 0.0000 64.4407 31.9911 174.2460 78 K 4.0684 9.6972 125.2326 56.2353 30.4301 178.6760 *87 G 4.0142 7.6637 110.3091 46.6644 0.0000 171.4208 88 E 4.6629 8.6054 118.2743 55.6897 30.9908 176.5049 89 T 4.5157 8.2978 119.3447 62.7971 69.5582 175.5329 90 V 3.8884 8.1850 118.9964 61.5385 33.2825 178.1601 91 G 3.7202 8.2620 108.5765 46.2870 0.0000 173.0378 92 E 4.1906 8.8418 123.8156 56.0382 30.9204 176.5181 93 V 4.7717 8.4124 126.7133 61.3109 33.6058 174.6729 94 R 4.6401 9.4367 127.3024 54.4553 32.4598 174.5840 95 A 5.1008 8.6292 126.3275 50.5181 20.7260 176.0567 96 V 4.4838 8.7882 115.4021 59.2369 35.5928 177.1611 97 A 4.1128 8.7235 123.9905 55.0720 20.2653 177.6158 98 D 4.6730 8.1868 113.4620 54.3719 42.9347 176.5863 *100 H 4.8076 9.5554 115.1465 55.8190 31.4540 175.1200 101 Q 4.0572 8.6674 118.2849 59.1743 28.2886 179.1250 102 R 3.9852 7.7272 118.1084 59.7787 30.1415 178.3705 103 K 4.2681 8.1029 115.7824 59.2128 32.4434 178.6469 104 A 4.4298 8.4083 121.2015 55.3268 18.3345 180.8143 105 E 4.2911 8.9738 115.8461 56.7269 29.4778 179.1640 *107 A 4.8916 7.9752 123.5558 52.4392 20.6769 179.7962 108 K 3.8779 8.2911 115.5526 59.8156 32.1978 177.1578 109 H 4.7979 8.0573 112.8839 55.5955 28.6947 174.7876 110 S 4.7361 7.6726 114.7692 56.8924 65.8911 173.4679 111 D 4.9117 8.4465 120.7434 54.9108 42.4595 176.0036 112 A 4.4014 6.7358 118.3460 50.9078 22.8719 174.8161 113 F 4.9815 8.8334 116.7570 55.8327 43.5585 174.5480 114 I 5.0858 8.7243 122.5270 59.5396 41.1548 174.0161 115 A 5.2558 9.1218 129.4037 50.4382 20.5928 176.8438 116 L 4.7628 8.7598 123.4604 53.3799 43.4549 175.2176 117 P 3.7067 0.0000 0.0000 63.6485 32.0656 176.5829 118 G 4.4974 7.2890 109.7350 45.2483 0.0000 174.2878 119 G 4.1049 7.9183 106.5629 44.5942 0.0000 175.4760 120 Y 4.5045 8.3796 118.6031 61.0482 38.0169 178.4283 121 G 3.6024 8.1521 106.1269 48.1376 0.0000 175.6182 122 T 3.8632 7.9126 118.1533 66.1781 68.5076 176.2608 123 L 3.9464 7.9878 122.1391 58.0073 42.2169 178.3772 124 E 3.7778 8.3406 119.5231 59.4689 29.5333 178.8060 125 E 3.4345 7.6421 118.1359 58.9209 29.3549 179.1045 126 L 3.7102 7.2369 120.1953 58.2164 42.1343 179.1229 127 L 3.8932 8.0430 119.2161 57.4208 41.3560 179.2663 128 E 3.3509 7.6231 119.2689 58.9920 29.4772 178.9518 129 V 3.3600 6.9389 112.3648 64.4782 31.4189 178.6583 130 I 3.6312 7.5945 119.0784 64.6796 36.9070 178.3975 131 T 3.8450 7.8738 116.7138 66.7102 68.3083 176.5681 132 W 4.4793 8.3358 120.7335 59.7631 29.0229 178.4452 133 A 4.4292 8.0867 122.1003 54.7691 17.6119 179.4731 134 Q 3.9566 8.1544 117.1481 59.1559 29.2432 177.8031 135 L 4.3113 8.0980 117.9519 55.3043 41.9737 177.8841 136 G 4.0152 7.8672 107.7188 45.1097 0.0000 174.6989 137 I 3.8149 7.6817 121.1484 64.1491 37.5735 175.6083 138 H 5.0157 7.7503 113.3242 54.6097 31.1916 172.2567 139 D 5.1510 8.4463 117.1995 53.7821 41.7543 175.6072 140 K 4.4620 8.7365 116.3486 55.1129 33.0844 175.5330 141 P 4.5157 0.0000 0.0000 63.0231 32.8740 175.2805 142 V 4.9446 8.6135 122.5083 61.1613 34.4606 174.2685 143 G 4.4623 9.3514 115.1868 44.3474 0.0000 171.2626 144 L 5.0005 9.1927 123.6367 52.7067 43.9903 175.7514 145 L 4.4836 8.8519 127.8247 54.1391 41.0306 175.8805 146 N 5.0382 9.2625 129.0993 51.8538 37.6106 173.0616 147 V 4.0211 7.9113 121.0231 63.6059 32.5710 175.5630 148 D 4.4588 9.7316 128.4139 55.7035 38.4860 174.1430 149 G 4.0633 8.3076 102.3708 46.3279 0.0000 175.1238 150 Y 4.0153 8.2159 122.3518 61.0204 38.7410 177.7426 151 Y 4.4843 8.6326 115.2876 58.1089 37.9565 176.9758 152 N 4.3882 8.3704 121.0101 56.8235 38.6779 177.4950 153 S 4.2805 7.9806 115.8080 61.2530 62.8960 176.4240 154 L 4.0811 7.8837 122.8276 58.1942 41.9281 178.8074 155 L 4.0622 8.1575 118.9773 57.9216 41.5349 179.6669 156 S 4.1381 8.4230 115.3455 61.4038 62.6613 176.4263 157 F 4.2236 8.3142 123.3582 61.5371 39.1872 177.3081 158 I 3.3708 7.7452 119.3106 64.3101 36.7864 178.1622 159 D 4.3093 8.3810 120.1613 57.0694 40.5186 178.7080 160 K 3.8510 8.0176 119.9036 59.4826 32.1440 178.5226 161 A 3.9545 7.7953 121.3501 55.2020 18.1538 179.8742 162 V 4.0843 7.6947 117.8755 65.7378 31.4537 177.7780 163 E 3.9354 8.2593 118.1237 59.1315 29.5200 177.7451 164 E 4.3918 8.3040 115.7669 56.0954 29.8096 177.1586 165 G 3.7133 7.8326 107.5356 45.4961 0.0000 174.5288 166 F 4.5990 8.0758 118.5138 57.8757 40.0403 176.2403 167 I 4.6455 7.4232 121.3538 58.3579 40.5902 175.0163 168 S 4.4885 8.4911 120.0228 57.6338 64.8293 173.3585 169 P 4.2335 0.0000 0.0000 66.3036 31.2070 178.8113 170 T 3.9946 7.8810 113.5684 66.7459 68.6477 176.4569 171 A 4.0756 8.3322 122.5669 54.7528 18.3934 179.5597 172 R 3.8671 8.1041 117.7846 59.5620 29.9451 178.1217 173 E 4.2011 7.8254 116.2683 58.0353 29.4281 178.5214 174 I 3.9910 7.2846 119.8551 63.3327 37.2471 176.0866 175 I 4.0933 7.2443 120.7957 60.7667 37.4729 176.0416 176 V 4.3263 8.7422 128.2359 61.6356 33.3216 174.6512 177 S 5.2806 8.4820 120.2155 56.9023 65.7335 172.4371 178 A 4.8402 8.7181 126.0170 50.5544 22.5063 175.3437 179 P 4.9379 0.0000 0.0000 63.4855 32.4753 176.7648 180 T 4.7615 7.4716 108.7892 58.8660 73.2367 174.2394 181 A 4.0046 8.5474 123.8577 55.2526 18.4480 180.0673 182 K 3.8775 7.9808 117.4301 59.8522 32.3876 178.5979 183 E 3.9977 7.9052 118.9653 59.3398 29.2787 179.3274 184 L 3.9429 8.0533 120.2005 58.2293 42.2599 179.1940 185 V 3.6023 7.9202 118.2507 65.6602 31.5974 177.5199 186 K 3.8641 8.1717 119.5148 59.8578 31.9795 178.7782 187 K 4.1313 8.3122 118.4746 59.4412 31.7111 179.3960 188 L 4.1361 8.1024 118.6387 57.9270 41.6413 178.9212 189 E 3.8509 8.1836 117.5989 57.7310 29.4329 176.8138 190 E 5.1747 7.7059 121.5940 57.5253 31.4685 174.1013 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 10 K 8.31 4.24 0.00 1.72 1.77 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.48 7.81 11 S 8.32 4.33 0.00 3.93 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 12 K 9.01 4.00 0.00 1.66 1.65 0.00 1.40 0.00 0.00 1.52 0.00 0.00 2.58 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.79 0.21 7.81 13 F 7.91 5.01 0.00 3.00 2.86 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 14 R 9.26 4.29 0.00 1.93 1.99 0.00 3.09 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 15 R 8.10 5.16 0.00 1.66 1.69 0.00 3.31 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 16 I 8.47 4.51 1.70 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 0.55 0.60 0.69 0.00 0.00 17 C 8.28 4.74 0.00 2.71 2.26 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 18 V 8.42 4.60 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 0.83 0.00 0.00 0.84 0.00 0.00 19 F 8.65 5.27 0.00 3.07 2.85 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 20 C 8.58 5.01 0.00 2.94 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 21 G 8.27 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.95 4.49 0.00 4.04 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 0.00 23 S 7.64 4.61 0.00 3.84 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 24 Q 8.54 4.03 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.41 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 25 G 7.69 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 0.00 0.00 0.00 26 K 8.41 4.30 0.00 1.78 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.47 7.81 27 K 7.63 4.46 0.00 0.97 1.24 0.00 1.34 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.31 1.29 7.81 28 S 8.72 4.32 0.00 3.82 3.80 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 0.00 0.00 0.00 0.00 29 S 7.76 4.06 0.00 3.97 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 30 Y 7.24 4.33 0.00 2.90 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 31 Q 8.02 4.06 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 32 D 8.57 4.46 0.00 2.65 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 33 A 8.30 4.04 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 34 A 7.96 3.92 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 35 V 7.62 3.49 2.08 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 1.05 0.00 0.00 0.97 0.00 0.00 36 D 8.48 4.38 0.00 2.83 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 37 L 8.51 4.01 0.00 1.79 1.82 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.15 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 39 N 8.56 4.39 0.00 2.86 2.87 0.00 0.00 6.74 7.28 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 40 E 8.37 3.90 0.00 2.26 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 2.47 2.41 0.00 41 L 8.05 3.95 0.00 1.83 1.86 0.86 0.79 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 42 V 7.70 3.57 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 1.04 0.00 0.00 0.96 0.00 0.00 43 S 8.13 4.19 0.00 4.05 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 44 R 7.58 4.40 0.00 1.85 2.01 0.00 3.35 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 45 N 8.04 4.23 0.00 2.89 2.91 0.00 0.00 6.79 6.95 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 46 I 7.99 4.54 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.78 0.92 0.00 0.00 47 D 8.82 4.78 0.00 2.78 2.70 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 48 L 8.56 5.08 0.00 1.68 1.42 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.69 5.06 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 1.08 0.00 0.00 0.94 0.00 0.00 50 Y 9.13 5.19 0.00 3.18 2.89 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 0.00 0.00 0.00 51 G 8.79 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 52 G 5.38 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 0.00 0.00 0.00 53 G 8.45 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 54 S 8.37 4.73 0.00 3.99 4.31 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 55 I 7.72 4.26 1.98 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 1.38 0.68 0.93 0.00 0.00 56 G 8.34 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 57 L 7.91 4.63 0.00 1.88 1.70 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 *59 G 8.13 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 0.00 0.00 0.00 0.00 60 L 7.87 3.95 0.00 1.87 1.71 0.98 0.83 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 61 V 8.03 3.69 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 0.80 0.00 0.00 0.85 0.00 0.00 62 S 7.62 3.73 0.00 3.39 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 63 Q 8.10 3.87 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 64 A 7.80 3.95 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 65 V 7.83 3.46 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 0.94 0.00 0.00 0.95 0.00 0.00 66 H 8.39 4.20 0.00 3.23 3.38 0.00 5.64 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 67 D 8.29 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0.00 0.00 0.00 0.00 0.00 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 L 9.19 5.00 0.00 1.51 1.50 0.71 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.85 4.48 0.00 1.68 1.83 1.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 146 N 9.26 5.04 0.00 3.01 2.91 0.00 0.00 6.69 7.74 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 0.00 147 V 7.91 4.02 2.43 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 1.17 0.00 0.00 1.08 0.00 0.00 148 D 9.73 4.46 0.00 2.99 2.77 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 0.00 0.00 0.00 149 G 8.31 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 0.00 150 Y 8.22 4.02 0.00 2.84 2.80 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 0.00 0.00 0.00 0.00 151 Y 8.63 4.48 0.00 3.26 2.94 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 0.00 152 N 8.37 4.39 0.00 2.80 2.90 0.00 0.00 7.02 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 0.00 153 S 7.98 4.28 0.00 3.78 3.89 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 0.00 0.00 0.00 154 L 7.88 4.08 0.00 1.90 2.01 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.16 4.06 0.00 1.96 1.74 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 156 S 8.42 4.14 0.00 4.04 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 0.00 157 F 8.31 4.22 0.00 3.21 3.33 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 0.00 158 I 7.75 3.37 1.83 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 1.80 0.79 0.85 0.00 0.00 159 D 8.38 4.31 0.00 2.82 2.70 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 0.00 160 K 8.02 3.85 0.00 1.88 1.88 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.52 7.81 161 A 7.80 3.95 1.06 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 0.00 162 V 7.69 4.08 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 1.32 0.00 0.00 1.01 0.00 0.00 163 E 8.26 3.94 0.00 2.03 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 2.32 2.35 0.00 164 E 8.30 4.39 0.00 2.21 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 2.55 2.58 0.00 165 G 7.83 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 0.00 166 F 8.08 4.60 0.00 3.16 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 0.00 167 I 7.42 4.65 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.31 0.90 0.00 0.00 168 S 8.49 4.49 0.00 4.03 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 0.00 169 P 0.00 4.23 0.00 2.03 2.17 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.18 0.00 170 T 7.88 3.99 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 1.22 0.00 0.00 171 A 8.33 4.08 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 0.00 172 R 8.10 3.87 0.00 1.93 2.15 0.00 3.13 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 173 E 7.83 4.20 0.00 2.11 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 2.56 2.50 0.00 174 I 7.28 3.99 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 1.54 0.52 0.93 0.00 0.00 175 I 7.24 4.09 1.86 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 1.09 0.46 0.88 0.00 0.00 176 V 8.74 4.33 2.22 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 0.95 0.00 0.00 0.97 0.00 0.00 177 S 8.48 5.28 0.00 3.88 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 0.00 178 A 8.72 4.84 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 0.00 179 P 0.00 4.94 0.00 2.24 2.24 0.00 3.36 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 2.14 1.94 0.00 180 T 7.47 4.76 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 1.30 0.00 0.00 181 A 8.55 4.00 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 0.00 182 K 7.98 3.88 0.00 1.85 1.83 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.55 7.81 183 E 7.91 4.00 0.00 2.16 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 2.36 2.35 0.00 184 L 8.05 3.94 0.00 1.88 1.82 1.00 0.74 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 0.00 185 V 7.92 3.60 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 1.05 0.00 0.00 0.98 0.00 0.00 186 K 8.17 3.86 0.00 2.11 2.01 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.53 7.81 187 K 8.31 4.13 0.00 2.01 1.89 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.68 7.81 188 L 8.10 4.14 0.00 1.89 1.85 0.84 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.18 3.85 0.00 2.13 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 2.74 2.52 0.00 190 E 7.71 5.17 0.00 2.42 2.28 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 2.21 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.