NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.2276 8.4449 121.4667 55.9377 30.9164 174.8757 6 Q 4.2295 8.3615 124.5671 52.2454 29.6458 174.1303 7 P 4.0037 0.0000 0.0000 65.6066 31.9171 176.4306 8 Y 4.6707 7.7038 113.1941 57.6852 38.2573 175.1799 9 H 5.0661 8.3917 116.5366 55.5668 29.8270 173.1379 10 H 4.9688 7.8279 112.4829 53.5226 31.6470 173.1924 11 G 3.9258 8.4908 110.4935 44.5282 0.0000 173.9763 12 S 4.2770 8.2879 114.2603 57.9684 64.7849 175.0558 13 L 3.9631 8.5033 124.2925 58.1131 41.4443 179.7605 14 R 3.6396 7.6863 117.8976 59.3552 29.9652 178.3968 15 R 3.8970 7.9428 118.2565 59.6930 30.2639 178.9745 16 V 3.7074 7.8865 112.2111 64.2227 31.5102 178.6932 17 L 4.0685 8.3943 119.2653 57.8027 41.5327 179.4434 18 L 4.0418 8.2067 118.7613 57.6751 41.5528 179.5341 19 A 3.9921 8.0384 120.6648 55.2171 18.3133 179.9330 20 R 3.8437 7.9525 116.1566 59.2373 30.1354 178.9391 21 A 3.9467 8.4751 120.9267 55.3311 18.2939 179.3388 22 E 3.8084 8.2579 117.6022 59.2749 29.6895 178.7289 23 S 4.0458 8.0566 113.1827 61.9042 62.3559 176.3578 24 T 3.8374 8.2199 118.5949 66.3787 68.1708 176.1365 25 L 3.9910 8.4460 122.5211 58.5612 41.8870 179.1310 26 E 3.9695 8.1245 116.8196 58.7705 29.3727 178.8486 27 K 4.1600 7.6996 118.4531 58.4657 32.6926 177.6097 28 D 4.8266 8.5750 116.0612 52.2629 42.0438 176.9536 29 G 4.0342 7.8851 110.1873 44.1835 0.0000 175.2480 30 V 3.6391 8.1280 117.6765 64.6665 31.2807 178.3603 31 D 4.4231 8.0743 119.1948 56.6826 40.8583 177.6684 32 G 3.6693 7.8827 107.2826 47.3535 0.0000 173.7090 33 L 4.2037 7.3939 120.6614 54.2117 42.2324 176.8967 34 S 4.5492 8.3495 117.0060 55.3882 65.6309 173.8988 35 L 3.9142 8.5341 130.6004 58.3947 42.0511 178.9530 36 R 3.9185 7.9927 117.4422 59.3875 30.0049 178.6402 37 Q 3.9617 8.1578 119.0847 59.2629 29.0792 178.2699 38 L 4.2205 8.6062 121.5160 57.0380 41.7239 179.2638 39 A 3.9936 8.3078 120.9835 55.4068 18.3775 179.8060 40 R 3.8933 8.0624 116.3677 59.6229 30.1376 179.1472 41 E 4.0024 8.4548 118.0894 59.1649 29.2519 178.4426 42 A 4.4767 7.8368 117.9837 52.3079 18.7613 178.0683 43 G 3.8873 7.8776 106.2658 45.0002 0.0000 174.2339 44 V 3.8071 7.4292 119.4873 61.1185 32.0730 175.5353 45 S 4.7756 8.0826 116.3529 56.2795 66.1841 174.0710 46 H 3.9434 8.9319 118.8086 59.2271 29.3592 175.9293 47 A 3.9194 7.4060 121.3906 54.2085 18.6155 177.7885 48 A 4.5265 7.6752 125.7550 49.8556 19.3431 174.3487 49 P 4.7974 0.0000 0.0000 62.4570 32.1161 176.7247 50 S 4.1996 7.9177 114.8083 58.7256 62.6611 173.5986 51 K 4.4906 8.3716 125.6091 56.5809 32.6014 175.3678 52 H 4.1001 7.8560 122.0570 57.8869 29.7890 174.8220 53 F 4.2352 7.7122 117.3770 57.0196 39.5748 175.6109 54 R 4.0127 8.8066 126.0055 59.3920 30.1086 175.8589 55 D 4.5867 7.6628 115.2844 51.2889 43.0642 175.8571 56 R 3.8023 8.4684 118.5157 59.8470 29.8000 177.8233 57 Q 3.9270 8.1868 118.4130 59.2032 28.9930 178.0512 58 A 4.0411 8.6356 122.0632 54.8770 18.3694 179.3746 59 L 2.7309 7.5141 118.6904 57.9771 42.0865 179.2068 60 L 3.9017 7.8649 118.9014 57.9343 41.4823 179.2882 61 D 4.3639 8.4533 118.9118 57.3550 40.7154 178.7689 62 A 4.0820 8.0512 121.3293 54.9774 18.3352 179.7610 63 L 3.8880 8.1156 117.4932 57.8262 41.7040 179.5381 64 A 3.9172 8.1600 120.8172 55.0844 18.2691 179.3007 65 E 4.0307 8.4689 117.9613 59.5133 29.7878 178.7908 66 S 4.2115 8.3545 113.3986 61.4436 62.3530 176.3726 67 G 3.6004 8.2221 108.2781 47.9034 0.0000 175.6288 68 F 4.1714 8.0249 120.4491 60.2718 38.9235 177.7612 69 L 4.0459 8.3501 118.8094 57.9493 41.3302 179.8285 70 R 4.0583 8.2161 117.9918 58.7275 29.9360 178.8270 71 L 2.8573 7.8733 120.5033 58.0112 41.9100 179.0748 72 T 3.7826 7.9870 115.5244 66.5912 68.3063 176.4069 73 A 3.9560 8.0172 122.4207 55.0882 18.3993 179.5460 74 A 3.9600 8.1857 119.3766 55.3077 18.4602 179.9080 75 L 3.9572 8.1615 117.7791 57.8961 41.6835 179.5986 76 E 3.9501 8.4283 118.7452 59.5431 29.3857 179.5738 77 R 3.9245 8.2718 118.0142 59.1958 30.1946 178.9596 78 A 3.9721 8.0799 120.5345 55.0777 18.1562 179.7567 79 V 3.5251 7.5231 115.6439 66.2336 31.6902 177.4503 80 E 4.0550 8.0529 117.6535 59.3947 29.5013 178.1485 81 E 4.0459 8.2547 118.3210 58.0441 29.9700 177.0799 82 A 4.2824 7.0385 120.0330 50.9799 19.3716 176.7751 83 E 4.1062 8.5470 119.1421 56.7513 30.0969 178.2502 84 S 4.2545 8.5945 117.2452 61.6294 63.4414 175.7110 85 H 4.5254 7.9430 115.3942 54.8916 30.5511 175.9752 86 A 4.0176 8.5179 124.0250 55.3822 18.2504 180.0786 87 R 2.5100 7.2453 116.2437 58.9235 29.9840 178.5029 88 A 3.8178 7.1931 119.9292 55.0899 18.4215 179.6777 89 R 3.9252 7.9925 116.6306 59.3198 30.2352 179.2815 90 F 4.2672 8.9605 117.8921 60.6890 38.9718 177.6120 91 A 4.0103 8.0939 120.1199 55.0327 18.1324 179.6050 92 A 3.9385 8.1154 119.3984 55.0765 18.3912 179.8198 93 L 3.8945 8.0484 117.3234 57.8562 41.7148 179.5960 94 A 3.5696 7.6320 120.2189 54.8769 18.0607 179.8906 95 G 3.5227 7.8977 103.9871 47.9620 0.0000 175.8073 96 A 4.0239 8.1383 123.5085 54.7494 18.2888 178.9284 97 Y 3.9676 8.3687 118.5037 60.9617 38.9075 178.6357 98 V 3.6083 7.9659 118.9248 66.1728 31.6904 178.0211 99 S 4.1010 8.2970 115.0099 61.5371 62.6965 176.4632 100 F 3.9510 8.3650 122.9902 61.3013 38.9314 176.9115 101 A 3.9728 7.8226 119.1213 55.2973 18.2212 179.2950 102 L 4.0530 7.7413 115.8721 57.1255 41.8767 178.7664 103 A 4.0974 7.5796 119.0888 53.1962 19.8365 176.8783 104 H 4.8233 7.5727 113.8822 54.0090 29.9355 174.9680 105 R 3.9275 7.8168 122.3875 59.6342 30.5253 178.9207 106 E 3.9962 8.5553 118.2841 58.9599 29.1969 179.0922 107 L 3.8402 8.1176 120.0101 57.9761 42.2170 178.4714 108 L 3.7254 7.8537 119.0828 57.9319 42.2281 178.3299 109 A 4.2637 7.8311 120.6206 55.0498 18.2493 180.2890 110 L 4.1931 7.8024 116.1948 56.0533 41.7932 178.2796 *112 Y 5.2807 7.9758 117.1575 57.7611 39.9950 177.8203 113 G 3.7258 8.6182 108.0927 48.7490 0.0000 174.4279 114 N 4.4626 8.9386 119.8000 56.2012 39.1828 176.7456 115 K 3.9064 8.4502 117.4491 59.3901 32.2197 176.6481 116 H 4.7224 7.8618 112.3502 55.2928 29.3011 175.0012 117 A 4.2649 7.7753 123.4491 50.7371 18.9332 175.5301 118 P 4.2390 0.0000 0.0000 64.4291 31.6390 176.6141 119 G 3.8677 8.9341 110.3986 46.0733 0.0000 173.3371 120 A 3.9786 7.5865 121.1967 51.9264 19.0367 179.1561 121 A 4.1446 8.5073 123.4578 51.9441 20.2555 179.0747 122 S 4.0589 8.7670 119.4690 61.7561 62.9508 177.1155 123 Q 4.1718 8.0422 120.6022 58.7291 28.2595 178.7098 124 V 3.5901 7.6670 119.8551 65.8083 31.7964 177.8517 125 V 3.3195 7.5984 118.0249 65.8631 30.8433 177.3621 126 E 3.7266 8.4904 118.9740 59.3655 29.2627 178.5927 127 A 4.0689 7.8404 119.3160 55.1395 18.8874 179.3782 128 G 2.6045 7.6147 104.1682 48.0038 0.0000 175.6656 129 H 4.2926 7.7735 117.0512 58.1338 28.9339 177.3769 130 A 4.1696 7.6039 122.4412 55.0792 17.5950 179.9356 131 S 4.0103 7.4275 109.1213 59.5792 62.4469 175.8746 *133 D 4.5171 8.1587 122.9474 54.3507 42.7861 177.6214 134 L 3.9257 7.9057 120.5087 58.4104 41.9668 179.2641 135 T 3.7788 7.4995 108.9059 64.7538 68.6398 176.6132 136 V 3.5327 7.6785 120.7819 65.6018 31.4846 177.7300 137 R 3.8844 8.2656 118.6568 59.5597 29.9185 178.5093 138 I 3.7661 7.9442 119.6567 64.3948 37.0716 178.6301 139 V 3.8805 8.0150 119.1187 66.3928 31.3297 178.2227 140 T 4.0731 8.2975 115.8150 66.7882 68.2225 176.4243 141 E 3.9883 8.5801 120.4559 59.4272 29.3842 179.3184 142 A 4.1145 8.2705 120.8142 55.3737 18.6029 179.7731 143 Q 3.9259 8.4821 116.4469 58.8712 28.5394 178.7115 144 A 4.0164 8.0612 121.1309 55.0551 18.5854 179.1983 145 A 4.1866 8.2739 117.7395 52.9215 18.4308 178.3261 146 G 3.8517 7.6330 104.6765 46.3400 0.0000 174.7283 147 D 4.5485 8.3623 122.3040 55.5897 41.1860 176.2107 148 I 4.3305 7.2279 110.1477 58.2910 41.0784 175.2584 149 G 3.8628 8.3923 110.6281 45.0919 0.0000 171.6767 150 P 4.5783 0.0000 0.0000 61.9571 32.3067 176.1544 151 G 4.2192 8.5100 107.7937 43.0086 0.0000 173.0317 152 D 4.3496 8.2868 118.9834 54.0566 41.6010 176.2440 153 A 4.0967 8.6839 130.6155 55.1937 18.5507 179.0322 154 S 4.0875 8.5946 113.0476 61.4659 63.1328 176.9786 155 R 4.0176 8.1006 121.3665 58.8381 29.9625 178.6770 156 I 3.8160 7.9410 119.4724 64.5268 37.1261 178.3188 157 A 4.0557 8.3049 121.7283 55.0120 18.0665 179.4301 158 L 3.9654 7.9210 118.5722 58.3075 42.1046 179.3499 159 V 3.5384 8.0959 118.0464 65.8395 31.4607 177.7288 160 A 3.3151 7.9977 120.4609 54.9896 18.1817 179.3425 161 F 4.1891 8.3805 118.9579 61.3164 39.4086 177.0417 162 A 3.5750 8.1232 120.6123 55.3796 18.1554 179.4488 163 T 3.4569 7.7289 114.3737 66.9966 68.4465 176.7088 164 F 4.3366 7.8525 118.9200 60.2072 38.9995 177.6442 165 H 4.6126 8.7114 118.8768 58.9753 29.4790 177.4896 166 G 3.5362 8.3889 108.0963 47.8688 0.0000 175.6296 167 I 3.6897 7.8598 122.5351 63.9807 37.0790 178.3747 168 A 4.0422 8.3406 121.6005 55.4910 18.2106 179.8413 169 T 3.7788 8.1912 114.4842 66.6755 68.3015 176.8605 170 L 3.9324 7.9303 119.6025 57.8574 41.8839 179.2006 171 A 4.1206 8.3110 120.6368 55.1435 18.1001 179.5782 172 A 4.1035 8.2265 118.6457 54.6157 18.5120 179.0881 173 G 4.0497 7.8195 101.8004 43.2917 0.0000 172.1024 174 G 3.6144 7.4869 113.5777 45.4113 0.0000 173.9071 *176 L 4.1218 7.8268 123.9927 53.2302 44.1717 176.3175 177 D 4.3081 9.2253 117.3920 55.1894 39.3246 174.0450 178 G 3.9164 8.2161 105.0868 45.2823 0.0000 173.2534 179 A 4.1358 7.6737 123.5706 50.9524 19.1101 175.7900 180 P 4.3664 0.0000 0.0000 62.2994 32.2541 177.4109 181 V 3.6354 8.8316 123.9194 65.4840 30.9135 178.0859 182 D 4.3386 8.1351 118.0111 56.9437 41.0394 177.8603 183 E 4.1054 8.1513 119.0515 58.9596 29.3990 179.3600 184 V 3.6530 7.6490 118.1373 65.7453 31.6986 178.0206 185 V 3.8859 8.1064 118.1817 66.4526 31.3821 178.0761 186 T 3.9131 7.8553 114.7083 66.6427 68.3651 176.3278 187 A 4.0508 8.1144 122.3497 55.2740 18.3496 179.5355 188 A 4.0346 8.4811 119.5132 55.4289 18.3949 180.0199 189 S 4.5627 8.9233 114.1192 62.0889 62.9870 176.7111 190 D 4.5459 8.7557 121.9408 57.7833 40.5565 179.0646 191 T 3.9844 8.2257 116.2177 66.4911 68.3513 176.3970 192 F 4.3446 8.7026 122.8043 61.2267 39.5276 176.7714 193 W 4.1645 8.7410 127.9015 60.8171 30.2983 178.1373 194 R 3.9768 8.1701 116.5884 59.0990 29.5963 178.9728 195 G 3.6593 8.1602 104.0208 46.5287 0.0000 174.7600 196 L 4.3334 7.0632 120.4285 55.1237 43.4753 176.2450 197 A 4.1666 6.9244 120.9852 51.1845 15.6217 177.3542 198 Q 4.0902 7.8294 121.1963 55.5361 29.3200 175.9231 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 5 E 8.44 4.23 0.00 1.88 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 2.16 2.29 0.00 6 Q 8.36 4.23 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 7 P 0.00 4.00 0.00 1.12 1.90 0.00 3.75 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 1.95 1.95 0.00 8 Y 7.70 4.67 0.00 2.94 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 9 H 8.39 5.07 0.00 3.12 3.25 0.00 5.60 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 7.83 4.97 0.00 3.18 3.21 0.00 5.52 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 11 G 8.49 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 12 S 8.29 4.28 0.00 4.00 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 13 L 8.50 3.96 0.00 1.68 1.75 0.95 0.84 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 14 R 7.69 3.64 0.00 1.05 1.69 0.00 3.01 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.42 0.00 15 R 7.94 3.90 0.00 1.99 1.90 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 16 V 7.89 3.71 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 0.96 0.00 0.00 1.05 0.00 0.00 17 L 8.39 4.07 0.00 2.03 1.88 1.12 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.21 4.04 0.00 1.98 1.76 1.08 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.04 3.99 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 20 R 7.95 3.84 0.00 1.92 1.99 0.00 3.26 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 21 A 8.48 3.95 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 22 E 8.26 3.81 0.00 2.03 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 0.00 2.27 2.27 0.00 23 S 8.06 4.05 0.00 3.93 3.99 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 24 T 8.22 3.84 4.36 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 1.26 0.00 0.00 25 L 8.45 3.99 0.00 1.91 1.78 0.89 1.05 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 26 E 8.12 3.97 0.00 1.93 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 2.45 2.40 0.00 27 K 7.70 4.16 0.00 1.72 1.80 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 28 D 8.57 4.83 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.89 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 30 V 8.13 3.64 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 0.74 0.00 0.00 0.92 0.00 0.00 31 D 8.07 4.42 0.00 2.68 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 32 G 7.88 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.39 4.20 0.00 1.83 1.58 0.87 0.62 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 34 S 8.35 4.55 0.00 3.81 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 35 L 8.53 3.91 0.00 1.76 1.65 1.02 1.14 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 36 R 7.99 3.92 0.00 1.90 1.98 0.00 3.20 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 37 Q 8.16 3.96 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 38 L 8.61 4.22 0.00 1.85 1.72 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.31 3.99 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 40 R 8.06 3.89 0.00 2.04 2.00 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 41 E 8.45 4.00 0.00 2.18 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 2.33 2.40 0.00 42 A 7.84 4.48 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 43 G 7.88 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 44 V 7.43 3.81 2.09 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 0.77 0.00 0.00 1.02 0.00 0.00 45 S 8.08 4.78 0.00 4.11 3.99 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 46 H 8.93 3.94 0.00 3.13 3.39 0.00 5.74 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 47 A 7.41 3.92 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 48 A 7.68 4.53 1.23 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 0.00 0.00 0.00 49 P 0.00 4.80 0.00 2.15 2.17 0.00 3.36 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.83 0.00 50 S 7.92 4.20 0.00 3.83 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 51 K 8.37 4.49 0.00 1.94 1.86 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.47 7.81 52 H 7.86 4.10 0.00 3.07 3.17 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 7.71 4.24 0.00 3.16 3.15 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 54 R 8.81 4.01 0.00 1.79 2.02 0.00 3.29 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 55 D 7.66 4.59 0.00 2.96 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 56 R 8.47 3.80 0.00 1.88 1.97 0.00 3.17 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 57 Q 8.19 3.93 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 58 A 8.64 4.04 1.57 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 59 L 7.51 2.73 0.00 1.01 1.58 0.25 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.86 3.90 0.00 1.82 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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 0.00 120 A 7.59 3.98 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 0.00 121 A 8.51 4.14 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 0.00 122 S 8.77 4.06 0.00 4.03 4.13 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 0.00 123 Q 8.04 4.17 0.00 2.28 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 124 V 7.67 3.59 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 1.28 0.00 0.00 1.06 0.00 0.00 125 V 7.60 3.32 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 0.69 0.00 0.00 0.85 0.00 0.00 126 E 8.49 3.73 0.00 2.25 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 2.27 2.29 0.00 127 A 7.84 4.07 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 0.00 128 G 7.61 2.60 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 0.00 129 H 7.77 4.29 0.00 3.17 3.29 0.00 5.69 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 0.00 130 A 7.60 4.17 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 0.00 131 S 7.43 4.01 0.00 3.96 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 *133 D 8.16 4.52 0.00 2.84 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 0.00 134 L 7.91 3.93 0.00 1.76 1.82 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.50 3.78 4.13 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 1.19 0.00 0.00 136 V 7.68 3.53 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 1.11 0.00 0.00 0.89 0.00 0.00 137 R 8.27 3.88 0.00 2.00 2.07 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 138 I 7.94 3.77 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.64 1.06 0.00 0.00 139 V 8.02 3.88 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 1.14 0.00 0.00 0.87 0.00 0.00 140 T 8.30 4.07 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 1.23 0.00 0.00 141 E 8.58 3.99 0.00 2.22 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 0.00 2.37 2.50 0.00 142 A 8.27 4.11 1.62 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 0.00 0.00 143 Q 8.48 3.93 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 144 A 8.06 4.02 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 0.00 145 A 8.27 4.19 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 0.00 146 G 7.63 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 0.00 147 D 8.36 4.55 0.00 2.91 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.23 4.33 1.67 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.60 0.02 0.00 0.00 149 G 8.39 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 0.00 0.00 0.00 150 P 0.00 4.58 0.00 1.93 1.98 0.00 3.65 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 151 G 8.51 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 0.00 0.00 0.00 0.00 152 D 8.29 4.35 0.00 2.72 2.60 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 0.00 153 A 8.68 4.10 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 0.00 154 S 8.59 4.09 0.00 4.04 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 0.00 155 R 8.10 4.02 0.00 2.00 2.04 0.00 3.31 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.67 0.00 156 I 7.94 3.82 2.06 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 1.48 0.85 1.08 0.00 0.00 157 A 8.30 4.06 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 0.00 158 L 7.92 3.97 0.00 1.96 1.87 1.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 159 V 8.10 3.54 2.42 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 1.15 0.00 0.00 1.04 0.00 0.00 160 A 8.00 3.32 1.23 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 0.00 0.00 0.00 161 F 8.38 4.19 0.00 2.86 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 0.00 162 A 8.12 3.57 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 0.00 163 T 7.73 3.46 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 164 F 7.85 4.34 0.00 3.14 3.31 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 0.00 165 H 8.71 4.61 0.00 2.89 2.94 0.00 5.79 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 0.00 166 G 8.39 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 I 7.86 3.69 2.13 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 1.01 0.00 0.00 168 A 8.34 4.04 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.19 3.78 4.35 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 1.19 0.00 0.00 170 L 7.93 3.93 0.00 1.83 1.73 0.90 1.11 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 0.00 171 A 8.31 4.12 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 0.00 172 A 8.23 4.10 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 0.00 173 G 7.82 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 0.00 0.00 0.00 0.00 174 G 7.49 3.61 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 0.00 0.00 0.00 *176 L 7.83 4.12 0.00 1.75 1.87 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 177 D 9.23 4.31 0.00 2.71 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 0.00 178 G 8.22 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 0.00 179 A 7.67 4.14 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 0.00 180 P 0.00 4.37 0.00 2.21 2.01 0.00 3.65 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.08 0.00 181 V 8.83 3.64 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 0.79 0.00 0.00 0.98 0.00 0.00 182 D 8.14 4.34 0.00 2.83 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 0.00 183 E 8.15 4.11 0.00 2.27 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 2.35 2.33 0.00 184 V 7.65 3.65 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 1.15 0.00 0.00 1.02 0.00 0.00 185 V 8.11 3.89 2.18 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 1.07 0.00 0.00 1.16 0.00 0.00 186 T 7.86 3.91 4.43 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 1.26 0.00 0.00 187 A 8.11 4.05 1.44 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 0.00 0.00 0.00 188 A 8.48 4.03 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 0.00 189 S 8.92 4.56 0.00 4.14 4.13 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 0.00 190 D 8.76 4.55 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 0.00 191 T 8.23 3.98 4.37 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 1.29 0.00 0.00 192 F 8.70 4.34 0.00 3.34 3.56 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 0.00 193 W 8.74 4.16 0.00 3.66 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 0.00 194 R 8.17 3.98 0.00 2.04 1.99 0.00 3.27 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.96 0.00 195 G 8.16 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 7.06 4.33 0.00 1.06 1.33 0.30 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 197 A 6.92 4.17 0.73 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 0.00 198 Q 7.83 4.09 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.60 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 * Residues marked with a * may have inaccurate shift predictions.