NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8044 8.1100 120.4237 54.4676 34.1814 173.7446 2 L 4.6331 7.6582 120.0068 52.6942 44.8043 173.4678 3 D 4.9802 9.5237 127.4275 52.4460 44.6064 174.8183 4 I 4.8389 8.3226 122.8568 60.0663 39.6024 174.8707 5 T 4.5802 8.6748 124.8683 62.0347 70.6100 174.2066 6 T 4.4807 8.6111 123.8143 63.1524 69.4933 174.1326 7 I 4.6050 8.5978 129.0054 60.4289 39.2173 175.3163 8 T 5.0026 8.9958 116.8935 58.5033 72.0073 174.5946 9 R 3.9766 8.0141 121.0514 59.0778 30.0714 177.6570 10 Q 4.2281 8.0302 116.1372 57.6325 29.2749 176.2133 11 N 4.9955 7.9962 113.7590 52.2158 38.3176 176.5200 12 V 3.4518 7.8381 121.7205 66.6780 31.6165 177.7078 13 T 3.1004 7.4369 107.5411 62.7579 68.5873 174.5540 14 S 4.5607 7.5092 116.2661 58.2381 64.0302 174.9850 15 V 3.7744 7.5036 122.4745 61.0993 31.8880 176.1508 16 V 3.1557 7.8733 115.7940 62.9179 31.6511 176.7578 17 G 3.0356 8.0892 111.2982 45.5079 0.0000 173.7424 18 Y 4.0222 7.6483 121.9211 59.5407 39.0066 175.4483 19 Y 4.7037 7.8512 115.8433 56.3803 40.0945 174.5042 20 S 4.6725 8.1669 115.8604 57.3795 66.2898 172.9213 21 D 4.6695 8.3754 120.1539 52.9407 41.6593 177.8157 22 A 3.9469 8.8413 129.3538 55.8640 18.5713 179.6981 23 K 4.1379 8.0093 115.8646 56.7133 32.1275 179.0086 24 D 4.9995 7.6010 116.8949 53.2105 42.5865 176.4640 25 D 4.3424 8.6146 122.3458 55.9271 41.4961 176.0200 26 Y 4.8382 7.5402 114.4065 55.9710 41.2854 175.4318 27 Y 4.2226 8.2174 119.3544 60.8851 38.0769 176.2596 28 S 4.3800 7.9261 117.5410 57.3061 63.5287 173.3528 29 K 4.1493 8.4483 131.5337 56.5315 32.3078 176.0466 30 D 4.5682 10.4707 122.6067 53.0899 37.2427 171.7983 31 S 4.6935 7.8173 113.2064 58.3137 66.0433 173.5302 32 S 4.6045 8.2092 112.5306 58.0607 63.3749 174.8077 33 F 4.4070 8.2033 121.8480 60.4280 39.5432 175.1328 34 T 5.4063 7.9433 106.2071 59.1721 71.4950 173.6294 35 S 5.3723 7.5671 114.9217 58.0818 66.1713 173.5114 36 W 5.0214 8.6937 121.6063 56.8006 30.1019 175.5173 37 Q 4.6470 9.7233 122.0517 54.8497 33.4510 175.3441 38 G 4.3262 8.9363 105.4329 46.5005 0.0000 175.0385 39 T 4.1239 10.3473 118.5843 65.9766 68.4362 177.8185 40 G 3.8351 8.4006 108.0110 47.7032 0.0000 175.5122 41 A 3.9023 8.1790 123.0221 55.0346 18.3817 179.2303 42 E 3.8537 8.1523 117.3206 59.3279 29.5179 178.8021 43 A 4.2843 8.0469 119.8379 54.6745 18.4939 178.5840 44 L 4.3878 7.5992 114.7550 54.2798 41.9778 177.1764 45 G 3.8035 8.2425 107.4558 46.2483 0.0000 173.2467 46 L 4.4389 7.6624 119.9163 52.4021 43.0180 176.2953 47 S 4.7730 8.6462 116.5527 58.4426 66.3396 175.9886 48 G 3.9128 8.7627 107.8178 45.0895 0.0000 172.3143 49 D 4.7277 8.6295 120.8436 54.9940 40.3432 176.6401 50 V 3.8330 8.6002 122.9165 61.8951 32.8678 174.5588 51 E 4.0761 9.2272 130.1475 55.6161 30.1841 177.1895 52 S 4.4012 8.6073 124.5175 61.0544 62.8426 176.5742 53 A 3.9374 7.7581 123.7702 54.7593 18.1179 179.4741 54 R 3.8675 7.9570 116.8487 59.3945 30.3219 178.1035 55 F 4.4688 8.7797 120.7882 61.6705 39.5458 177.3616 56 K 3.8531 8.3447 117.9179 59.0356 31.7001 179.3078 57 E 3.9743 8.0746 118.9772 59.5421 29.4689 179.4663 58 L 3.8481 8.0259 118.9485 57.3042 41.3598 178.9991 59 L 3.8920 7.3877 119.8467 57.9064 41.8722 178.9659 60 V 4.3772 7.0611 107.8789 60.8277 32.4164 176.4969 61 G 3.7563 7.9510 106.2707 46.0171 0.0000 173.8021 62 E 4.3504 7.9070 122.1565 54.2480 28.2710 176.1474 63 I 3.5518 8.2831 126.3157 63.4665 37.5646 175.8712 64 D 4.5061 7.3924 116.8427 52.2659 41.8380 175.4025 65 T 3.8939 8.3278 112.9877 64.7231 67.0244 174.2898 66 F 4.7079 7.8844 117.0141 57.7340 39.7075 175.9722 67 T 4.6161 8.3650 118.2933 61.9589 70.7663 171.4399 68 H 5.3593 8.5898 122.4134 53.7799 30.8850 174.4431 69 M 4.2694 9.0993 124.0708 55.4698 32.7279 176.4099 70 Q 4.4363 8.7342 122.3094 54.9432 28.9252 175.5602 71 R 4.4096 8.6417 123.2577 56.5222 31.6421 176.5195 *72 H 4.6930 8.2234 117.9145 53.9346 28.2211 181.3767 73 V 4.4242 9.1683 123.7351 55.1037 31.9198 172.5095 74 G 3.8912 8.3604 113.0356 44.1451 0.0000 170.1434 75 D 4.3188 8.6181 118.1099 53.7207 39.7805 173.6676 76 A 4.1473 8.7339 127.5168 53.7020 18.5001 178.8108 77 K 4.3078 7.9689 113.6556 58.0654 33.2478 178.4263 78 K 4.1351 7.8036 118.8092 57.2237 32.7671 177.0422 79 E 3.9969 7.6707 117.4945 56.3087 29.7213 176.6622 80 R 4.1572 8.5327 122.8910 56.2183 31.1061 176.1609 81 L 4.4513 9.2788 122.1493 54.4417 44.1459 176.5128 82 G 3.8993 6.6155 103.0767 46.5056 0.0000 170.4872 83 Y 5.0391 7.1851 116.9389 56.2175 42.1062 174.5578 84 D 5.0329 9.4712 125.5970 53.3714 42.4587 175.5884 85 L 4.7136 8.8705 128.4972 54.0320 42.5822 176.1226 86 T 4.7535 8.6521 122.7897 62.2851 70.0424 174.1833 87 F 4.8292 8.9622 126.6968 55.9944 40.4088 175.1783 88 S 5.2772 9.0013 120.4903 56.4874 65.3157 174.0184 89 A 4.5511 8.9549 126.6456 50.8869 19.1939 175.7671 90 P 4.2487 0.0000 0.0000 62.3512 32.3579 177.8303 91 K 3.9740 8.6987 121.1934 59.7735 32.0515 179.4458 92 G 3.5323 8.6200 106.2375 47.6672 0.0000 175.7752 93 V 3.5205 7.7377 120.2698 65.9554 31.5698 178.3150 94 S 4.1329 8.3486 115.1758 61.8404 62.5699 176.6664 95 M 4.0229 8.1557 121.5295 58.3484 31.7839 178.5462 96 Q 3.9824 8.3226 119.7086 59.0250 29.0608 178.3088 97 A 4.0798 8.0632 121.6423 55.2497 18.3479 179.4038 98 L 4.1325 8.1920 115.8378 56.8307 42.2184 178.3097 99 I 4.0618 7.8251 118.4174 62.8583 37.6342 176.2761 100 H 4.7352 8.1263 114.7148 54.8330 29.4441 174.9854 101 G 3.9430 8.1019 106.8839 46.0139 0.0000 173.7336 102 D 4.5648 7.8515 120.3850 52.9724 40.4551 176.9104 103 K 4.0895 8.5515 127.5750 59.3082 32.0494 179.3100 104 T 3.9470 8.3319 116.6542 66.5840 68.2535 176.6085 105 I 3.6269 7.7284 121.5652 64.3287 37.0699 178.4893 106 I 3.6702 7.6782 120.1543 64.3573 36.9513 177.9290 107 E 3.8892 8.1607 119.7821 59.1985 29.4302 178.7293 108 A 3.9553 8.0908 120.8492 55.2661 18.4575 178.9020 109 H 4.1062 8.4876 117.0255 59.6631 29.9138 177.2052 110 E 3.9436 8.3605 120.1973 59.3971 29.2318 179.5558 111 K 3.9193 8.2590 118.2695 59.4372 32.1026 179.2887 112 A 3.9071 8.1561 121.1483 54.9907 18.2087 179.9042 113 V 2.9499 7.9143 116.5586 65.8507 31.5179 177.9728 114 A 3.9435 8.0549 120.3560 55.1737 18.2026 179.5003 115 A 3.8728 8.1660 118.9536 55.3281 18.5046 179.7562 116 A 3.9732 8.0241 119.3727 55.1743 18.5024 180.0289 117 V 3.5978 8.1216 117.2454 66.2800 31.3960 178.5029 118 R 3.9903 8.0253 116.8699 59.3688 30.0534 178.5998 119 E 4.1337 8.4268 118.1774 59.3068 29.4300 179.2423 120 A 4.0579 8.1930 120.9472 55.1613 18.3933 179.4503 121 E 3.9994 8.1918 116.7865 59.5689 29.2794 179.6741 122 K 4.0760 7.7299 117.7270 58.7802 32.1200 178.2216 123 L 4.4669 7.5334 116.7197 53.5359 42.2968 176.1870 124 A 4.3277 7.3886 122.9353 51.9592 19.5765 176.9489 125 Q 5.1634 8.6377 119.7989 54.4148 34.0318 173.8277 126 A 4.9514 8.6082 121.1459 50.5251 22.9324 176.1716 127 R 4.4150 8.5973 120.0306 56.7284 31.3312 175.5486 128 T 4.6517 8.7743 118.2711 61.9957 72.0343 173.0015 129 T 4.9641 8.3002 118.8603 59.2056 70.4405 172.7296 130 R 3.9813 9.1163 129.4300 57.8436 30.2885 175.2269 131 Q 4.5125 7.3288 117.9194 52.4136 29.2770 175.6353 132 G 4.2533 8.6691 114.2310 45.4966 0.0000 172.5915 133 K 4.4729 7.5121 119.5496 53.3239 33.2767 178.2098 134 S 5.3431 8.3447 116.7044 57.7560 64.2980 174.2033 135 V 4.5348 8.6955 123.1150 60.2048 34.8964 174.5308 136 T 4.6206 8.5867 120.4221 63.2182 69.5269 173.5939 137 Q 4.5483 8.9222 128.4803 54.2459 31.1678 174.1561 138 N 5.0185 8.8619 124.8422 53.7155 38.2908 174.8171 139 T 4.2456 8.9834 114.0549 60.0162 71.4730 174.4805 140 N 5.0238 8.5611 118.6281 52.4432 37.5503 173.0704 141 N 5.3065 7.6190 112.2603 51.4358 40.6688 173.7424 142 L 5.0467 9.0523 121.4594 52.9010 46.6351 175.2157 143 V 4.7751 8.4780 120.7770 61.4114 33.7460 174.5156 144 V 5.1918 8.9891 127.4518 61.2203 34.9543 173.6588 145 A 4.9528 9.4656 130.2192 50.4157 21.1324 175.2368 146 T 5.1596 8.3645 113.5420 59.9754 71.7269 173.6151 147 F 4.9757 9.3369 123.5019 55.6685 42.2467 173.8989 148 R 4.7937 9.5671 126.4160 55.7318 31.1129 175.0877 149 H 5.0027 9.1998 123.7568 54.3260 31.2792 173.4573 150 E 4.7353 8.9447 123.8205 55.0598 29.3844 174.3388 151 T 4.2267 8.4996 120.0064 62.7497 68.4154 176.0440 152 S 4.2080 8.7614 123.8488 60.3963 62.6791 173.3098 153 R 4.5892 7.3942 117.1048 54.2637 33.6051 174.6256 *156 D 4.2888 8.4539 120.1684 52.9955 40.9594 172.5013 157 P 4.4473 0.0000 0.0000 63.2280 32.0281 176.1559 158 D 4.5682 8.8118 122.2639 52.5755 43.5357 172.8052 159 L 4.5649 8.9717 128.6777 54.2908 43.2886 174.9910 160 H 5.4928 8.6549 120.8015 54.8346 32.9023 172.2729 161 T 5.0798 8.9679 114.9130 62.1844 72.5109 173.1834 162 H 4.9159 9.5393 123.9576 55.1208 30.0887 174.6053 163 A 4.8469 9.3053 128.1917 50.4888 19.8028 175.1560 164 F 4.9176 9.8000 125.2044 58.2044 40.7313 174.8798 165 V 4.4637 8.4795 128.6697 62.0380 32.1560 175.4204 166 M 4.4106 8.9236 128.7591 55.4556 32.5935 177.0993 167 N 4.9913 8.3285 122.0005 51.8187 36.6493 173.6574 168 M 5.1036 7.8344 116.4461 54.8668 34.4302 174.8216 169 T 4.9020 9.2245 114.0679 61.1740 71.7130 171.9897 170 Q 3.7641 8.6139 128.7285 54.5635 29.6264 176.0512 171 R 4.2821 8.5664 126.4441 55.2059 31.0753 177.1974 172 E 3.8029 9.2244 120.7423 59.2791 29.4745 177.2661 173 D 4.5140 7.9534 115.5221 53.1883 39.7396 177.1355 174 G 3.8129 8.0768 109.1288 45.3342 0.0000 173.8835 175 Q 4.2869 8.2381 120.0033 55.2503 30.1552 175.1753 176 W 4.9434 8.7711 123.6463 56.3360 30.1126 175.8505 177 R 4.9472 9.1680 122.5542 53.8115 34.5356 174.5329 178 A 4.6458 8.6478 122.1579 51.8873 19.1416 177.3819 179 L 4.1398 8.5755 123.8686 55.1977 43.3337 176.9503 180 K 4.2738 9.1177 128.4889 55.5348 31.5117 176.3212 181 N 4.5500 8.5442 124.0527 53.2796 37.7364 176.1952 182 D 4.3080 7.5815 121.8978 58.0230 40.7812 178.5270 183 E 3.9820 8.0131 116.9365 59.0345 29.9148 178.6739 184 L 4.0504 7.7681 119.9613 58.6112 42.0056 178.9382 185 M 4.0865 7.9772 117.5557 57.7808 31.9421 177.9774 186 R 4.4105 7.6276 113.1394 56.4328 30.1724 176.3950 187 N 5.0025 7.5984 116.4741 53.0945 39.7297 176.4106 188 K 3.8541 8.2517 121.5677 59.9951 32.1935 178.1556 189 M 4.0518 8.0177 117.8606 58.7656 32.1361 177.3329 190 H 4.1510 8.2397 117.8329 59.4678 30.1325 176.9234 191 L 4.1247 8.2600 120.9291 57.9380 41.4891 179.8773 192 G 3.8006 8.3465 105.5570 47.9882 0.0000 175.4913 193 D 4.5524 8.2336 121.1352 56.7469 40.7610 179.0513 194 V 3.5615 8.0533 119.2116 66.0471 31.5425 177.2886 195 Y 4.0507 8.1037 119.2562 60.6767 38.6592 178.0224 196 K 3.9209 8.3167 120.3339 59.7056 32.2816 178.7470 197 Q 3.9576 8.5266 118.6281 59.1304 28.6063 178.6850 198 E 3.9497 8.3595 119.7617 58.9682 29.3188 179.2747 199 L 3.7529 7.8494 120.3833 57.9423 42.1125 178.7506 200 A 3.1426 7.6656 120.6577 54.8238 18.1848 179.4100 201 L 3.8579 8.0119 117.7450 58.1054 41.7334 179.7582 202 E 3.9527 8.2369 118.3128 59.3851 29.4540 179.4157 203 L 4.0913 8.0670 119.1650 58.2159 41.8185 179.7022 204 T 3.9047 8.2109 116.0155 66.6255 68.1633 176.6394 205 K 3.9949 8.0819 120.2380 59.2130 32.2944 178.3313 206 A 4.2225 7.8270 119.9259 52.8294 18.4811 178.0212 207 G 3.9611 7.5372 103.9348 45.0964 0.0000 173.7100 208 Y 4.2471 7.6486 117.6675 57.6791 38.9036 174.9112 209 E 4.4402 8.8977 124.2825 55.5026 31.1624 174.7890 210 L 5.1556 8.5718 126.1819 52.9029 45.0395 175.4871 211 R 4.5589 8.9466 123.1556 54.9533 32.0930 174.2402 212 Y 5.1515 8.6915 123.7467 56.5150 40.2599 174.6673 213 N 4.7226 9.1481 123.4453 52.0793 39.7198 175.4100 214 S 4.0750 9.0884 124.6291 61.9430 62.8611 175.8245 215 K 4.0090 8.2596 120.6003 57.4870 31.2287 178.8313 216 N 4.8530 8.3208 113.5284 51.4668 37.6938 174.0399 217 N 4.2189 7.9922 115.5235 55.8200 37.7683 172.3357 218 T 5.1225 7.6162 107.1539 59.9488 72.9559 172.7379 219 F 5.3467 8.3272 114.6678 56.1629 41.2813 172.5569 220 D 4.2414 8.7276 118.1215 52.9096 45.3052 173.9749 221 M 4.4966 8.5246 120.5635 55.3533 32.5098 176.5995 222 A 3.8433 8.8849 126.0426 52.6485 18.9775 176.9304 223 H 3.8876 8.5989 121.0018 55.1916 25.0870 175.0201 *224 F 4.5496 7.7457 120.8474 56.6949 41.4636 176.4976 225 S 4.3871 8.8009 116.9052 59.0711 61.8881 175.6525 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 M 8.11 4.80 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.64 0.00 2 L 7.66 4.63 0.00 1.43 1.36 -0.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 3 D 9.52 4.98 0.00 2.50 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.32 4.84 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.51 0.95 0.00 0.00 5 T 8.67 4.58 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 1.24 0.00 0.00 6 T 8.61 4.48 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 1.18 0.00 0.00 7 I 8.60 4.60 2.04 0.00 0.00 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 1.51 1.43 0.95 0.00 0.00 8 T 9.00 5.00 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 1.18 0.00 0.00 9 R 8.01 3.98 0.00 1.96 1.99 0.00 3.30 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 10 Q 8.03 4.23 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 11 N 8.00 5.00 0.00 2.78 2.91 0.00 0.00 6.44 8.35 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 12 V 7.84 3.45 1.72 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 1.08 0.00 0.00 0.92 0.00 0.00 13 T 7.44 3.10 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 0.94 0.00 0.00 14 S 7.51 4.56 0.00 4.00 3.97 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 15 V 7.50 3.77 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 0.95 0.00 0.00 0.67 0.00 0.00 16 V 7.87 3.16 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 0.00 0.00 0.15 0.00 0.00 0.53 0.00 0.00 17 G 8.09 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 0.00 0.00 0.00 18 Y 7.65 4.02 0.00 2.95 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 19 Y 7.85 4.70 0.00 3.04 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 20 S 8.17 4.67 0.00 3.70 3.62 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 21 D 8.38 4.67 0.00 2.79 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 22 A 8.84 3.95 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 23 K 8.01 4.14 0.00 1.79 1.74 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.36 1.03 7.81 24 D 7.60 5.00 0.00 2.64 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 25 D 8.61 4.34 0.00 2.68 2.29 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 26 Y 7.54 4.84 0.00 2.90 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 27 Y 8.22 4.22 0.00 3.15 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 28 S 7.93 4.38 0.00 4.02 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 29 K 8.45 4.15 0.00 1.80 1.64 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.00 7.81 30 D 10.47 4.57 0.00 2.80 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 31 S 7.82 4.69 0.00 4.08 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 32 S 8.21 4.60 0.00 3.88 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 33 F 8.20 4.41 0.00 3.09 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 34 T 7.94 5.41 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 1.06 0.00 0.00 35 S 7.57 5.37 0.00 3.88 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 36 W 8.69 5.02 0.00 3.25 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.72 4.65 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.44 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 38 G 8.94 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 0.00 0.00 0.00 0.00 39 T 10.35 4.12 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 1.24 0.00 0.00 40 G 8.40 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 41 A 8.18 3.90 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.15 3.85 0.00 2.09 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 2.34 2.40 0.00 43 A 8.05 4.28 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 44 L 7.60 4.39 0.00 1.62 1.46 0.32 0.51 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 45 G 8.24 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 0.00 0.00 0.00 46 L 7.66 4.44 0.00 1.13 0.14 -0.22 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.65 4.77 0.00 4.02 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 48 G 8.76 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 49 D 8.63 4.73 0.00 2.36 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 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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 0.00 109 H 8.49 4.11 0.00 3.31 3.62 0.00 5.79 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 0.00 110 E 8.36 3.94 0.00 2.19 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 2.51 2.46 0.00 111 K 8.26 3.92 0.00 1.92 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.59 7.81 112 A 8.16 3.91 1.22 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 0.00 113 V 7.91 2.95 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 0.82 0.00 0.00 0.70 0.00 0.00 114 A 8.05 3.94 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 0.00 115 A 8.17 3.87 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 0.00 116 A 8.02 3.97 1.20 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 0.00 125 Q 8.64 5.16 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 126 A 8.61 4.95 1.20 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 0.00 0.00 0.00 127 R 8.60 4.41 0.00 1.72 1.88 0.00 3.21 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 128 T 8.77 4.65 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 1.24 0.00 0.00 129 T 8.30 4.96 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 0.00 130 R 9.12 3.98 0.00 1.82 1.76 0.00 3.18 0.00 0.00 3.26 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 131 Q 7.33 4.51 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 132 G 8.67 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 0.00 0.00 0.00 0.00 133 K 7.51 4.47 0.00 1.69 1.68 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.39 1.02 7.81 134 S 8.34 5.34 0.00 3.75 3.81 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 0.00 135 V 8.70 4.53 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 0.74 0.00 0.00 0.92 0.00 0.00 136 T 8.59 4.62 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 0.00 137 Q 8.92 4.55 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.00 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 138 N 8.86 5.02 0.00 2.64 2.75 0.00 0.00 7.01 7.54 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 0.00 139 T 8.98 4.25 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 1.26 0.00 0.00 140 N 8.56 5.02 0.00 2.81 2.87 0.00 0.00 7.13 7.79 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 0.00 141 N 7.62 5.31 0.00 2.98 2.73 0.00 0.00 6.58 7.67 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 0.00 142 L 9.05 5.05 0.00 1.67 1.66 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 143 V 8.48 4.78 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 1.14 0.00 0.00 0.96 0.00 0.00 144 V 8.99 5.19 2.35 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 1.11 0.00 0.00 1.07 0.00 0.00 145 A 9.47 4.95 1.17 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 0.00 0.00 146 T 8.36 5.16 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 1.25 0.00 0.00 147 F 9.34 4.98 0.00 2.77 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 0.00 148 R 9.57 4.79 0.00 1.79 1.95 0.00 3.18 0.00 0.00 3.48 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 149 H 9.20 5.00 0.00 2.81 3.10 0.00 5.64 0.00 0.00 0.00 0.00 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168 M 7.83 5.10 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 169 T 9.22 4.90 4.34 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 1.36 0.00 0.00 170 Q 8.61 3.76 0.00 0.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.72 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 171 R 8.57 4.28 0.00 2.04 1.85 0.00 3.16 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 172 E 9.22 3.80 0.00 1.92 1.94 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 2.28 2.22 0.00 173 D 7.95 4.51 0.00 2.77 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 0.00 174 G 8.08 3.81 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 0.00 0.00 0.00 175 Q 8.24 4.29 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.90 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 176 W 8.77 4.94 0.00 3.20 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 0.00 177 R 9.17 4.95 0.00 1.70 1.81 0.00 3.33 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 178 A 8.65 4.65 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 0.00 179 L 8.58 4.14 0.00 1.86 1.84 1.02 0.66 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 0.00 180 K 9.12 4.27 0.00 1.83 1.82 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.38 7.81 181 N 8.54 4.55 0.00 2.55 2.88 0.00 0.00 6.17 8.07 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 0.00 182 D 7.58 4.31 0.00 2.88 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 0.00 183 E 8.01 3.98 0.00 2.04 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 2.30 2.30 0.00 184 L 7.77 4.05 0.00 1.63 1.64 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 185 M 7.98 4.09 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.69 0.00 186 R 7.63 4.41 0.00 1.99 2.02 0.00 3.16 0.00 0.00 3.21 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.65 0.00 187 N 7.60 5.00 0.00 2.91 2.87 0.00 0.00 6.60 7.20 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 0.00 188 K 8.25 3.85 0.00 1.79 1.80 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.48 1.44 7.81 189 M 8.02 4.05 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 190 H 8.24 4.15 0.00 3.30 3.51 0.00 5.93 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 0.00 191 L 8.26 4.12 0.00 1.94 1.90 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 192 G 8.35 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 0.00 0.00 0.00 193 D 8.23 4.55 0.00 2.93 2.78 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 0.00 0.00 0.00 0.00 194 V 8.05 3.56 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 1.10 0.00 0.00 0.81 0.00 0.00 195 Y 8.10 4.05 0.00 3.13 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 0.00 196 K 8.32 3.92 0.00 2.14 2.08 0.00 1.88 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.69 1.78 7.81 197 Q 8.53 3.96 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 198 E 8.36 3.95 0.00 1.96 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 2.40 2.42 0.00 199 L 7.85 3.75 0.00 1.31 1.68 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 200 A 7.67 3.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.01 3.86 0.00 1.91 1.69 0.87 0.76 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 0.00 202 E 8.24 3.95 0.00 2.11 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 2.44 2.46 0.00 203 L 8.07 4.09 0.00 1.74 1.74 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 204 T 8.21 3.90 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 1.23 0.00 0.00 205 K 8.08 3.99 0.00 1.87 1.98 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.45 7.81 206 A 7.83 4.22 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 G 7.54 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 0.00 208 Y 7.65 4.25 0.00 3.07 2.92 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 0.00 209 E 8.90 4.44 0.00 2.09 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 2.36 2.37 0.00 210 L 8.57 5.16 0.00 1.29 1.17 0.58 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 211 R 8.95 4.56 0.00 1.78 1.72 0.00 3.07 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 212 Y 8.69 5.15 0.00 2.92 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 0.00 213 N 9.15 4.72 0.00 2.78 2.76 0.00 0.00 6.60 7.51 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 0.00 214 S 9.09 4.07 0.00 3.90 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 0.00 215 K 8.26 4.01 0.00 1.81 1.74 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.03 7.81 216 N 8.32 4.85 0.00 2.85 2.93 0.00 0.00 7.09 8.08 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 0.00 217 N 7.99 4.22 0.00 2.91 2.95 0.00 0.00 6.86 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 0.00 218 T 7.62 5.12 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 1.25 0.00 0.00 219 F 8.33 5.35 0.00 2.56 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 0.00 220 D 8.73 4.24 0.00 2.53 2.40 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 0.00 221 M 8.52 4.50 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.47 0.00 222 A 8.88 3.84 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 0.00 223 H 8.60 3.89 0.00 3.38 3.41 0.00 5.81 0.00 0.00 0.00 0.00 5.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *224 F 7.75 4.55 0.00 2.31 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 0.00 0.00 0.00 225 S 8.80 4.39 0.00 3.62 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 * Residues marked with a * may have inaccurate shift predictions.