NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 Q 4.3669 8.3293 119.1185 54.3825 29.2121 174.6587 14 V 3.9324 8.3622 124.2539 60.4674 32.3434 174.0530 15 K 4.5914 9.5869 122.7719 54.5686 35.8819 176.3295 16 V 4.7573 7.9159 123.4639 61.0910 34.4511 174.1398 17 F 5.3014 9.2207 125.3176 55.7046 43.6407 173.4360 18 R 4.9399 8.9442 122.0569 54.2449 32.4816 175.0304 19 A 4.4224 8.9500 129.2706 52.3574 18.8011 178.0792 20 L 4.1604 8.8971 123.2857 56.5724 42.5249 176.8616 21 Y 5.0166 7.5823 113.6508 56.0824 42.2326 175.4624 22 T 4.2945 8.8892 118.5817 63.9750 69.4207 173.4033 23 F 4.7691 10.3913 128.5326 56.5013 41.5399 173.7243 24 E 4.6076 8.0059 126.0024 53.5851 30.9460 174.5524 25 P 4.2527 0.0000 0.0000 62.7025 32.1845 176.1577 26 R 4.4977 8.9084 117.1716 56.1656 32.4771 176.4522 27 T 4.7243 7.4293 113.4951 60.6680 71.9011 173.1254 28 P 4.3542 0.0000 0.0000 65.4105 31.7124 177.6687 29 D 4.4779 8.0473 117.3943 56.1087 41.1500 175.4850 30 E 5.2821 7.6032 118.4704 54.2369 30.8925 176.3980 31 L 4.2266 8.7592 125.3319 55.8470 42.8124 177.7242 *32 Y 4.5505 8.4763 123.5662 56.4464 35.8782 173.3035 33 I 4.3410 8.4107 126.7197 59.8518 39.0558 174.9972 34 E 4.3648 8.9823 126.4392 54.2113 32.1328 175.3087 35 E 3.9463 8.4227 122.6016 58.4635 29.8792 177.7883 36 G 3.9207 9.0687 115.0547 45.1544 0.0000 173.4356 37 D 4.5130 8.0297 120.1170 54.3991 42.1011 175.3998 38 I 4.6451 8.0911 122.2985 60.1889 38.8772 175.1242 39 I 4.7945 8.9744 127.2584 59.7056 40.5311 173.9772 40 Y 5.2134 9.2858 124.6868 56.4128 40.4387 174.7843 41 I 5.1357 9.2286 125.7414 59.9095 40.2658 176.2857 42 T 4.4928 8.1892 116.0806 62.0990 70.5007 174.1807 43 D 4.8149 7.8522 119.0688 51.9526 44.3614 175.0829 *45 S 4.5329 8.4611 116.4646 58.2615 64.8630 174.4688 46 D 4.7465 8.1124 119.3441 53.9783 41.4663 176.4636 47 T 4.1095 8.7730 112.6869 64.6790 69.2206 174.9925 48 N 4.5722 7.9956 117.6306 50.9321 41.9281 174.2333 49 W 5.2958 8.0300 117.0148 54.4750 32.7505 174.8971 50 W 5.3041 9.3866 123.7409 54.6653 32.5516 174.5231 51 K 4.7326 8.9557 125.2661 56.3218 32.8915 175.8397 52 G 4.6473 9.4346 113.8906 44.9295 0.0000 170.8786 53 T 5.3264 9.1585 116.6699 61.6939 71.8085 173.5866 54 S 5.0160 9.3241 120.3694 57.4723 66.5034 173.9036 55 K 3.9917 10.0767 124.6266 57.5799 29.5676 176.1377 56 G 4.0027 8.6848 104.2431 45.5049 0.0000 174.0959 57 R 4.7113 7.9669 118.7367 54.3923 32.7678 174.5916 58 T 5.0941 8.0543 117.9987 62.1431 71.0143 173.7379 59 G 4.0959 8.7136 111.4367 45.8842 0.0000 171.9266 60 L 5.1079 8.2920 119.7816 54.1854 43.4972 176.6455 61 I 4.6393 8.9778 123.0214 58.6248 41.0668 173.4823 62 P 4.0288 0.0000 0.0000 62.3325 31.5123 177.6215 63 S 2.7900 8.0561 118.9986 60.8296 62.3923 176.3590 64 N 4.0630 7.4481 120.1579 56.5125 38.6799 175.9429 65 Y 3.9026 7.3480 120.8732 60.7004 38.6374 178.2060 66 V 3.1669 7.4282 117.0009 65.8031 31.6426 177.3864 67 A 4.0794 7.5491 119.4801 54.8905 18.3492 178.8163 68 E 4.3172 8.0912 115.5847 57.5871 30.2396 177.1585 69 Q 4.8427 8.1367 115.9340 55.0412 31.1724 174.8160 70 A 5.1110 7.7348 119.3987 50.1204 22.7631 175.7696 71 E 4.8843 8.9841 118.0566 54.2164 32.2651 175.8772 72 S 4.2535 8.8552 117.7955 58.3243 64.3041 173.5927 73 I 4.3066 8.2650 123.2158 59.8077 38.2709 175.4723 74 D 4.3892 8.8809 128.1681 56.7075 41.3308 176.9925 75 N 5.0461 7.6099 114.7306 50.3993 39.1001 172.9864 76 P 4.0869 0.0000 0.0000 65.6766 31.8688 178.4921 77 L 3.6051 7.6640 119.5906 57.9897 41.9830 178.4105 78 H 4.1727 8.1866 115.6365 58.9000 28.7634 177.4214 79 E 3.8151 8.0947 119.9341 59.2740 29.3449 179.0715 80 A 3.9804 7.2775 120.4941 55.2285 18.2152 179.5287 81 A 3.9230 7.9682 119.1227 55.2305 18.2560 179.7293 82 K 4.0762 8.2220 117.5367 59.1106 32.3755 178.2420 83 R 4.4569 7.8508 113.1678 55.2368 30.1815 176.1150 84 G 3.4105 7.5140 107.4467 47.4357 0.0000 175.1020 85 N 4.7181 8.3350 120.2828 51.6193 38.2256 173.5833 86 L 3.9502 8.1304 128.4360 57.6908 42.6299 178.0325 87 S 4.1303 8.1147 112.6613 61.2582 62.3230 175.8738 88 W 4.4871 8.8465 131.1392 60.2837 30.4822 177.4176 89 L 3.7611 8.2067 120.6095 58.5037 41.3764 179.2971 90 R 3.9377 8.2131 117.7462 59.1840 30.1074 178.6536 91 E 3.9042 8.2543 118.8430 59.4160 29.7268 178.5292 92 C 4.1629 8.4371 117.0246 63.0303 28.2343 176.1711 93 L 3.9782 7.9453 120.2812 58.0116 40.9768 179.4021 94 D 4.4226 8.1754 117.9261 56.7315 40.6741 177.4543 95 N 4.7372 7.5273 117.1537 53.1206 38.9191 175.8236 96 R 3.9054 7.6892 116.6463 57.0293 27.3950 179.9260 97 V 3.7877 7.6413 119.3422 63.1639 32.2072 176.1480 98 G 3.7462 8.6660 116.9713 45.2673 0.0000 174.7643 99 V 3.6441 8.5157 124.2416 64.1223 31.5551 176.6163 100 N 4.8152 8.0189 115.4798 52.4660 38.6836 174.9804 101 G 3.8481 7.7814 108.3772 46.0467 0.0000 172.7717 102 L 5.0269 8.2250 122.4380 52.5484 44.0708 176.6077 103 D 4.8365 8.5706 124.5795 52.2053 40.9099 177.8061 104 K 3.9443 8.5106 119.2977 57.2913 31.7817 173.6824 105 A 4.3472 8.2384 118.7114 52.2804 18.9570 178.1669 106 G 3.9090 8.3359 105.0514 46.0964 0.0000 173.6066 107 S 4.3262 8.1654 115.8371 57.1868 63.8550 174.3028 108 T 4.9359 8.2420 115.4453 59.7902 71.6274 175.7924 109 A 4.0483 8.1732 122.4197 55.1146 18.2453 179.5070 110 L 3.8715 7.9204 118.4700 58.3647 42.1314 178.1817 111 Y 3.8990 7.9417 119.4588 60.8006 38.7454 178.5252 112 W 4.3262 7.9161 118.5784 59.3948 29.0468 178.4468 113 A 4.2758 8.4121 121.2242 55.5832 17.9861 179.5614 114 C 4.0427 8.1900 115.2703 63.1204 27.9690 175.6277 115 H 4.1069 8.1240 119.4291 58.7687 29.4227 176.4963 116 G 3.9998 8.0269 104.2457 43.4740 0.0000 173.6066 117 G 3.9710 7.5685 107.9488 47.2338 0.0000 175.4163 118 H 4.7573 8.0948 119.4334 53.8878 27.6937 175.0549 119 K 3.9836 8.3161 127.0720 58.9478 32.1144 177.5929 120 D 4.3475 8.0537 118.5029 56.5923 39.2699 178.3690 121 I 3.7941 7.6154 119.6072 63.8326 37.5233 177.8368 122 V 3.4494 7.4783 118.8344 66.0431 30.8725 178.5419 123 E 3.9303 7.8246 114.2998 57.4831 29.2712 178.7243 *125 L 4.2985 7.8874 121.6067 54.9951 43.5537 178.6572 126 F 4.8000 8.2619 115.2308 59.1945 38.8678 176.1440 127 T 4.2486 7.4171 110.2876 62.6333 69.2438 174.9777 128 Q 4.4275 7.7333 122.1003 53.8804 29.8647 173.9057 129 P 4.1913 0.0000 0.0000 64.4318 32.0341 175.8233 130 N 3.9998 8.8190 119.9615 54.0302 37.3347 174.4381 131 I 3.7445 7.6152 116.6481 61.1978 38.6884 174.2718 132 E 4.1894 9.4155 130.1747 55.9136 29.6873 176.0656 133 L 4.4591 8.5192 126.0043 55.7328 42.6842 177.1356 134 N 4.8995 8.3496 114.2629 52.6225 38.9596 174.3903 135 Q 3.9687 8.0219 120.9657 56.4480 29.4879 174.9551 136 Q 4.6449 8.4295 124.5021 54.1651 30.6688 175.6778 137 N 4.8373 8.1292 120.0372 50.8764 39.5189 175.2453 138 K 3.7790 8.3485 117.3283 60.0886 32.1456 178.0628 139 L 4.1221 7.8931 115.8096 54.7099 41.6178 178.1288 140 G 3.9630 8.5814 108.3736 45.4190 0.0000 173.0459 141 D 4.3178 8.0126 120.6827 53.7298 41.6404 176.4676 142 T 4.9828 8.3793 115.0006 59.4757 72.2833 175.6046 143 A 4.0136 8.5097 121.9603 55.2417 18.1689 179.5048 144 L 3.9372 7.9644 118.4986 58.3968 42.2375 178.5825 145 H 4.0976 8.2833 115.7876 58.9814 28.7195 177.5544 146 A 3.9362 7.8408 122.1796 55.0550 18.0236 179.5860 147 A 3.9198 8.2826 119.2326 55.1208 18.3263 179.6984 148 A 3.9006 8.2661 119.5270 55.1015 18.2686 179.6503 149 W 3.9923 8.1101 125.6154 60.4740 30.8301 177.7569 150 K 3.3247 8.3339 119.2012 57.5627 31.7182 177.7991 151 G 3.7212 8.1340 105.7544 45.2572 0.0000 173.2536 152 Y 4.6080 7.3831 118.1418 57.1290 38.4811 175.8656 153 A 4.1166 8.6783 128.6364 54.9276 18.6206 178.6941 154 D 4.4136 8.0799 117.4908 56.5204 39.6192 178.7959 155 I 3.7939 7.7797 120.9708 63.9035 37.1662 177.9341 156 V 3.6142 7.6928 118.9652 66.2727 31.2654 177.6054 157 Q 3.9939 8.4525 119.3364 59.3824 28.8543 178.5916 158 L 4.1083 8.0138 119.6405 57.8829 41.6412 179.5122 159 L 4.2736 8.2112 118.8292 57.8911 41.7370 179.5266 160 L 3.9738 8.3069 118.9066 57.9580 41.3976 179.5957 161 A 4.0425 8.0207 119.2895 54.8001 18.3704 179.0884 162 K 3.9672 7.6847 116.8297 56.9605 32.2454 177.1051 163 G 3.9300 7.4467 106.5650 45.2796 0.0000 173.8700 164 A 4.2154 8.0674 123.6609 52.0744 18.7708 178.6469 165 R 4.1959 9.0893 123.0453 56.4491 30.7259 176.7820 166 T 4.5654 8.4764 110.1101 61.4986 69.1421 174.0218 167 D 4.9012 8.0950 119.0008 53.1801 39.4626 175.1128 168 L 4.6925 7.7633 120.0815 53.4631 43.4951 175.5334 169 R 4.8744 8.3893 122.3090 54.3913 32.3952 175.8640 170 N 4.8280 8.5616 119.0002 50.6878 38.9779 175.9933 171 I 3.8408 8.1852 119.0610 64.5963 37.0421 177.3478 172 E 4.1859 8.1925 116.7213 56.3148 29.2448 177.0403 173 K 3.9743 8.4847 117.4071 56.8321 30.2513 175.6014 174 K 4.6535 8.1814 119.2878 55.0155 33.5593 176.8453 175 L 4.9417 9.4055 123.0658 53.0451 42.7342 177.8617 176 A 3.7511 8.4900 122.7880 55.4950 18.3690 178.7406 177 F 4.2529 8.4998 116.2819 61.7090 39.3239 177.7825 178 D 4.4062 7.7016 119.6972 53.6583 39.6184 176.2531 *180 A 4.2778 8.1912 120.6177 52.5357 19.4518 177.4899 181 T 4.2876 8.3601 112.3675 61.8583 70.0476 174.5122 182 N 5.0057 7.4570 119.2498 50.3626 41.8971 174.8361 183 A 4.0095 8.4858 122.0934 54.7916 18.4307 179.9716 184 A 3.9180 7.9628 119.2494 55.6667 18.7250 179.4777 185 C 4.1007 8.6254 115.1989 62.8092 28.0982 176.1441 186 A 3.9066 8.0181 122.3654 55.2657 17.7332 179.6096 187 S 4.1011 8.2793 110.7772 61.6420 62.5517 176.1022 188 L 4.1597 7.6830 120.1625 57.4927 41.4081 178.8560 189 L 4.3916 7.7831 117.2897 56.3224 42.0379 177.2417 190 K 4.0030 8.4122 123.9823 56.5996 32.3224 176.1413 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 13 Q 8.33 4.37 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 14 V 8.36 3.93 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 0.92 0.00 0.00 1.13 0.00 0.00 15 K 9.59 4.59 0.00 1.76 1.52 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.73 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.44 7.81 16 V 7.92 4.76 1.99 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 0.83 0.00 0.00 1.03 0.00 0.00 17 F 9.22 5.30 0.00 2.90 2.84 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 18 R 8.94 4.94 0.00 1.75 1.82 0.00 3.09 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.38 0.00 19 A 8.95 4.42 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.90 4.16 0.00 1.08 0.92 0.83 0.65 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 21 Y 7.58 5.02 0.00 3.11 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 22 T 8.89 4.29 4.33 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 1.24 0.00 0.00 23 F 10.39 4.77 0.00 2.04 2.57 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 24 E 8.01 4.61 0.00 1.66 1.68 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 2.13 2.18 0.00 25 P 0.00 4.25 0.00 2.31 2.27 0.00 3.56 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 26 R 8.91 4.50 0.00 1.80 1.97 0.00 3.15 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.40 0.00 27 T 7.43 4.72 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 1.21 0.00 0.00 28 P 0.00 4.35 0.00 2.02 2.11 0.00 3.65 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 2.01 2.09 0.00 29 D 8.05 4.48 0.00 2.62 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 30 E 7.60 5.28 0.00 2.14 2.14 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 2.75 2.24 0.00 31 L 8.76 4.23 0.00 1.60 1.69 1.00 0.96 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 *32 Y 8.48 4.55 0.00 2.09 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 0.00 0.00 0.00 33 I 8.41 4.34 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.93 1.03 0.00 0.00 34 E 8.98 4.36 0.00 2.12 1.87 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 2.28 2.26 0.00 35 E 8.42 3.95 0.00 1.98 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 2.34 2.40 0.00 36 G 9.07 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 37 D 8.03 4.51 0.00 2.76 2.62 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 38 I 8.09 4.65 1.80 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.27 0.68 0.00 0.00 39 I 8.97 4.79 2.02 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.88 1.04 0.00 0.00 40 Y 9.29 5.21 0.00 3.02 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 41 I 9.23 5.14 2.06 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 1.45 0.86 0.95 0.00 0.00 42 T 8.19 4.49 4.26 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 1.26 0.00 0.00 43 D 7.85 4.81 0.00 2.58 2.55 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 *45 S 8.46 4.53 0.00 4.08 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 46 D 8.11 4.75 0.00 3.10 2.84 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 47 T 8.77 4.11 4.23 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 0.00 0.00 0.00 1.25 0.00 0.00 48 N 8.00 4.57 0.00 2.36 2.11 0.00 0.00 7.37 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 49 W 8.03 5.30 0.00 3.13 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 50 W 9.39 5.30 0.00 3.24 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 K 8.96 4.73 0.00 1.95 1.78 0.00 1.71 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.52 7.81 52 G 9.43 4.65 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 53 T 9.16 5.33 4.42 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 1.28 0.00 0.00 54 S 9.32 5.02 0.00 3.95 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 55 K 10.08 3.99 0.00 1.95 1.89 0.00 1.90 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.39 7.81 56 G 8.68 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 57 R 7.97 4.71 0.00 2.03 1.84 0.00 3.12 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 58 T 8.05 5.09 4.28 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 1.33 0.00 0.00 59 G 8.71 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 0.00 0.00 0.00 102 L 8.22 5.03 0.00 1.62 1.58 0.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.57 4.84 0.00 2.85 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 0.00 104 K 8.51 3.94 0.00 1.80 1.78 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.01 7.81 105 A 8.24 4.35 1.30 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 0.00 106 G 8.34 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 0.00 107 S 8.17 4.33 0.00 4.33 3.39 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 0.00 108 T 8.24 4.94 4.26 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 1.23 0.00 0.00 109 A 8.17 4.05 1.30 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 127 T 7.42 4.25 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 1.29 0.00 0.00 128 Q 7.73 4.43 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 129 P 0.00 4.19 0.00 2.17 2.06 0.00 3.92 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 130 N 8.82 4.00 0.00 2.76 2.83 0.00 0.00 7.04 7.94 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 0.00 131 I 7.62 3.74 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.89 0.83 0.00 0.00 132 E 9.42 4.19 0.00 1.92 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 2.33 0.00 133 L 8.52 4.46 0.00 1.67 1.73 0.82 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 134 N 8.35 4.90 0.00 2.81 2.80 0.00 0.00 6.93 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 0.00 135 Q 8.02 3.97 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 136 Q 8.43 4.64 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 137 N 8.13 4.84 0.00 2.93 2.63 0.00 0.00 6.83 6.49 0.00 0.00 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 K 8.35 3.78 0.00 1.66 1.89 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.48 7.81 139 L 7.89 4.12 0.00 1.71 1.59 0.85 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.58 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 0.00 141 D 8.01 4.32 0.00 2.69 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 0.00 142 T 8.38 4.98 4.32 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 1.26 0.00 0.00 143 A 8.51 4.01 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 0.00 144 L 7.96 3.94 0.00 1.82 1.71 0.97 1.14 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 0.00 145 H 8.28 4.10 0.00 3.59 3.39 0.00 5.87 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.84 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.28 3.92 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 0.00 148 A 8.27 3.90 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 0.00 149 W 8.11 3.99 0.00 3.25 3.41 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 0.00 150 K 8.33 3.32 0.00 1.85 1.88 0.00 1.16 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 0.61 7.81 151 G 8.13 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 0.00 152 Y 7.38 4.61 0.00 2.94 3.01 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 0.00 153 A 8.68 4.12 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 0.00 154 D 8.08 4.41 0.00 2.88 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 0.00 155 I 7.78 3.79 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.80 0.92 0.00 0.00 156 V 7.69 3.61 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 1.12 0.00 0.00 1.00 0.00 0.00 157 Q 8.45 3.99 0.00 2.28 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 158 L 8.01 4.11 0.00 2.02 1.94 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.21 4.27 0.00 1.98 1.82 0.98 0.79 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 0.00 160 L 8.31 3.97 0.00 1.87 1.74 0.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.02 4.04 1.38 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 0.00 0.00 162 K 7.68 3.97 0.00 1.45 1.59 0.00 1.34 0.00 0.00 1.19 0.00 0.00 2.47 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.90 7.81 163 G 7.45 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 0.00 0.00 0.00 164 A 8.07 4.22 1.30 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 0.00 165 R 9.09 4.20 0.00 1.89 2.10 0.00 3.12 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 166 T 8.48 4.57 4.26 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 1.24 0.00 0.00 167 D 8.10 4.90 0.00 2.77 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 0.00 168 L 7.76 4.69 0.00 1.77 1.64 0.94 0.91 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 0.00 169 R 8.39 4.87 0.00 1.80 1.85 0.00 3.21 0.00 0.00 3.44 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 170 N 8.56 4.83 0.00 3.06 2.89 0.00 0.00 6.87 8.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.19 3.84 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.49 0.89 0.00 0.00 172 E 8.19 4.19 0.00 2.14 1.99 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 2.31 2.31 0.00 173 K 8.48 3.97 0.00 1.89 1.97 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.40 7.81 174 K 8.18 4.65 0.00 2.04 1.78 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.58 7.81 175 L 9.41 4.94 0.00 1.80 1.66 0.96 0.93 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 0.00 176 A 8.49 3.75 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 0.00 177 F 8.50 4.25 0.00 2.99 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 0.00 178 D 7.70 4.41 0.00 2.96 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 *180 A 8.19 4.28 1.10 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 0.00 0.00 181 T 8.36 4.29 4.05 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 1.06 0.00 0.00 182 N 7.46 5.01 0.00 2.90 2.83 0.00 0.00 6.13 7.13 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 0.00 183 A 8.49 4.01 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 0.00 184 A 7.96 3.92 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 0.00 185 C 8.63 4.10 0.00 3.06 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 0.00 186 A 8.02 3.91 1.30 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 0.00 187 S 8.28 4.10 0.00 3.92 4.12 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 0.00 188 L 7.68 4.16 0.00 1.86 1.76 0.95 1.30 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 0.00 189 L 7.78 4.39 0.00 1.94 1.97 0.99 0.77 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 0.00 190 K 8.41 4.00 0.00 2.20 1.73 0.00 1.97 0.00 0.00 1.78 0.00 0.00 3.43 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.16 7.81 * Residues marked with a * may have inaccurate shift predictions.