NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.5114 8.3144 121.7955 56.0249 34.1848 175.5574 9 F 4.4614 8.5906 120.0583 60.1545 40.0952 176.4759 10 S 4.1710 9.2647 116.7544 61.6522 63.8413 175.5245 11 D 4.4323 8.1536 119.2051 57.1157 41.0563 176.6042 12 N 4.5512 8.0437 114.9867 54.4386 41.0572 174.4572 13 Y 4.6659 7.0541 114.6242 57.0906 39.5324 174.7937 14 D 4.8935 8.4980 122.3220 52.2292 43.6220 175.4343 15 V 4.1489 8.6794 126.3687 62.9710 32.1337 175.7684 16 K 4.8774 8.2514 126.9028 55.9665 35.9304 174.7869 17 E 4.4436 8.7303 123.1717 57.2094 31.7378 175.0944 18 E 5.0998 8.5736 116.6524 55.6187 32.6474 174.5485 19 L 5.1962 7.7542 123.4799 56.7491 42.8365 174.9585 *25 S 4.5601 8.2176 115.9617 58.9799 64.9837 174.7379 26 V 4.0454 7.5434 119.6362 61.3270 33.2145 175.4150 27 V 5.0374 7.7298 113.9848 59.8646 36.1913 174.4104 28 R 4.5953 7.9927 115.8836 55.5697 33.0537 174.2576 29 R 4.9271 8.6147 121.8212 55.9906 32.1125 174.3354 30 C 5.8766 7.9877 114.2031 58.3850 32.4179 172.7596 31 V 4.8770 7.6671 118.1635 61.1275 34.7529 173.7902 32 H 4.2286 8.6099 127.1434 56.7121 30.4292 175.8965 33 K 3.4631 7.9553 126.4535 60.1611 31.9465 178.1210 34 T 3.8154 7.5008 115.8112 66.1171 68.5902 175.2068 35 T 4.0326 7.7421 111.7634 61.9586 69.8600 175.9800 36 G 4.4444 7.9499 109.3516 46.0672 0.0000 172.8914 37 L 4.1754 7.0885 120.8047 53.1891 42.6545 176.5184 38 E 4.1614 8.6344 123.6876 57.2911 30.2703 176.2352 39 F 5.4679 9.5344 120.7491 56.2757 44.5997 172.7339 40 A 4.9066 9.2673 120.3656 50.4531 21.5622 175.2183 41 A 5.0965 9.1175 125.6538 49.9202 21.2753 175.4827 42 K 4.1359 9.0875 124.8243 57.0482 33.6202 175.9261 43 I 4.4940 8.7692 128.3857 59.7749 39.3256 175.2576 44 I 4.4899 8.4017 128.5743 59.9293 39.8773 174.0729 45 N 5.7551 8.6655 120.6385 52.3848 42.5431 173.4393 46 T 4.2952 8.0702 118.1232 62.2173 70.2584 173.8800 *53 D 4.7040 8.7543 126.4653 54.3149 43.1120 178.0977 54 F 4.0630 8.1742 120.4818 61.1613 39.5096 176.1273 55 Q 4.2578 8.1166 118.7719 57.2607 29.4457 176.9172 56 K 4.1932 7.8163 116.6480 59.2483 32.1667 178.6059 57 L 4.0748 7.5027 118.6032 57.0985 41.7841 177.4770 58 E 3.6265 7.9360 118.9636 59.6972 29.0027 178.5826 59 R 3.7871 7.8322 117.2041 59.7073 30.0798 178.0161 60 E 3.9130 7.7399 116.7781 59.4891 29.9028 178.5467 61 A 4.0841 8.3051 120.8732 55.0491 18.3058 179.1907 62 R 3.8885 7.8217 117.2711 59.8814 29.9387 178.5115 63 I 3.6272 7.3595 118.7458 64.7766 36.6958 178.3080 64 C 3.8889 7.4950 115.4816 62.0709 27.6437 175.6320 65 R 4.0527 7.4352 119.1038 57.9182 29.8384 177.6295 66 K 4.4285 8.1322 117.3826 57.0327 32.8595 176.8010 67 L 4.7286 7.1133 118.4456 53.2663 40.5662 175.2110 68 Q 4.5021 8.5807 121.9855 53.9802 29.0634 174.5612 69 H 4.5708 7.9012 120.7337 53.4022 33.0989 172.5250 70 P 4.2963 0.0000 0.0000 65.4282 31.3938 176.8871 71 N 5.0039 8.0381 112.9890 52.0865 38.6759 173.5294 72 I 4.7542 8.0220 120.0246 59.2834 39.5845 174.7054 73 V 3.8592 8.3118 129.3692 62.9390 31.0039 174.9633 74 R 4.0740 8.5287 124.1787 55.6901 31.5124 174.8765 75 L 3.9722 8.3228 125.4522 54.8254 42.4598 175.2787 76 H 4.6809 8.7002 123.6649 57.1615 30.1777 174.9001 77 D 4.7612 7.4725 115.8288 52.4538 45.1340 173.5859 78 S 5.0831 8.6045 117.9850 56.5620 65.0581 173.1332 79 I 4.6598 8.7550 127.2414 59.6554 41.2873 173.8086 80 Q 4.8574 8.8303 128.1785 54.0124 30.1726 173.7568 81 E 4.6821 8.9174 126.5623 56.5223 27.4923 177.2983 82 E 4.1840 8.5946 127.8334 56.9311 29.8440 175.8345 83 S 4.5339 7.4930 115.7967 58.5424 66.1652 173.8656 84 F 5.3322 7.7286 119.6722 56.4698 41.3010 173.9821 85 H 5.4263 9.0359 121.9683 54.7048 32.6135 172.3342 86 Y 4.8710 9.0945 122.7527 56.0788 40.9863 174.6840 87 L 4.7906 8.8999 123.7248 52.8773 45.1992 176.0199 88 V 4.2891 8.3802 126.1969 62.0358 32.3742 174.9635 89 F 5.1435 9.4886 127.8998 55.1564 42.2470 175.0040 90 D 4.9532 8.4790 120.5875 55.1888 41.5808 176.2752 91 L 4.6636 8.7389 123.1999 53.4166 43.3962 175.8272 92 V 4.5660 8.3635 125.2381 61.2670 34.4686 174.8250 93 T 4.5123 8.0925 115.3183 62.1099 70.5398 176.0415 94 G 3.6559 7.9550 107.8815 45.9548 0.0000 174.7498 95 G 3.8973 8.1339 110.6693 44.7529 0.0000 173.2576 96 E 4.6261 8.2763 117.0802 55.8639 31.6997 177.7586 97 L 4.0171 9.1542 123.5435 57.9264 42.1179 178.9601 98 F 3.9268 8.3669 120.5128 61.5932 39.1436 176.8050 99 E 4.0662 8.4658 117.2268 59.6632 29.5277 178.8246 100 D 4.5422 8.0312 117.4143 56.7282 41.3060 178.0395 101 I 3.9406 7.3619 119.8704 63.9684 37.2272 178.4503 102 V 3.5370 7.3459 112.1265 63.8965 31.3146 177.5489 103 A 4.0774 8.1153 121.6046 55.2624 18.2160 178.6762 104 R 4.1713 7.7027 110.8452 55.8741 30.6196 176.8480 105 E 4.4082 8.5119 121.2054 55.3300 29.0050 174.7312 106 F 4.7626 6.8587 111.8701 56.5219 39.2290 173.2031 107 Y 4.2296 8.6876 122.0071 57.7234 38.5742 176.4099 108 S 4.5447 8.0950 116.9814 57.8711 65.3789 175.1362 109 E 4.2518 8.6868 121.4659 59.4770 29.1411 179.2738 110 A 4.1477 7.8333 120.3378 55.3849 18.4949 179.1846 111 D 4.2614 7.8693 116.5910 57.2164 40.7481 179.2059 112 A 4.1626 8.6434 121.6156 55.2751 18.5208 179.2482 113 S 3.6628 8.6283 112.7217 61.8728 62.0779 176.0247 114 H 4.0832 8.4091 120.8966 59.4669 29.0993 176.7805 115 C 4.1249 8.4657 120.9456 62.4490 31.3629 175.3285 116 I 3.8533 8.2477 120.6740 63.8571 37.6433 177.5496 117 Q 4.0208 8.2020 120.5772 59.0912 28.7692 178.5080 118 Q 3.9571 7.8384 119.0511 59.0004 28.8358 178.5764 119 I 3.6989 7.3772 119.7480 64.2332 37.0517 178.3126 120 L 3.9644 8.5552 120.0973 58.1329 41.5684 179.3140 121 E 3.9547 8.2790 118.4538 59.4951 29.2941 179.8510 122 S 3.9976 8.1207 114.0213 61.5711 63.1331 176.2301 123 I 3.5630 8.2050 124.3813 63.8545 36.9074 177.7484 124 A 4.0112 8.6151 121.6451 55.6943 17.7272 178.8041 125 Y 4.0483 7.9388 118.6228 60.4239 38.7561 178.0326 126 C 3.8977 8.4161 117.6697 63.4186 28.3179 176.1760 127 H 4.4532 8.4470 117.8921 58.8216 28.0427 177.7284 128 S 4.3681 8.4767 113.6451 59.7254 62.2493 174.5981 129 N 4.8155 6.9801 117.9319 52.9336 39.7324 175.1730 130 G 3.8997 8.8432 106.3713 45.7992 0.0000 173.2362 131 I 4.8383 7.9097 120.5993 59.1930 39.0465 175.2136 132 V 4.5686 8.3389 124.6135 61.3904 33.5273 175.6675 133 H 3.9534 9.6487 128.2165 59.3571 30.1028 175.7661 134 R 4.3435 8.5852 120.8725 56.6011 28.9074 177.9178 135 N 4.5661 7.6423 113.6098 53.2819 39.0591 175.1193 136 L 3.9653 7.6613 120.3594 53.9215 42.6127 175.1645 137 K 3.8531 7.6886 123.7845 54.6221 35.6268 175.0438 138 P 4.1936 0.0000 0.0000 65.8259 31.2606 178.4084 139 E 4.3727 8.1676 113.7537 57.7175 29.2732 176.5264 140 N 4.9593 8.2204 115.5484 52.5787 41.0551 173.3144 141 L 5.0256 8.0480 120.6164 53.0065 44.0591 175.5187 142 L 5.1418 9.0433 124.2168 53.1293 44.7948 175.4681 143 L 5.0862 8.4681 121.5231 53.2619 43.4035 177.4684 144 A 4.1412 9.0992 125.9033 54.8545 19.2733 177.5188 145 S 4.7348 7.6187 105.6813 57.5041 65.9755 173.2979 146 K 4.3708 8.4083 117.6657 56.4563 31.9621 177.0277 147 A 4.0725 7.7511 122.2929 52.5359 19.2725 179.1127 148 K 4.2358 8.5401 121.5844 53.4677 30.6097 177.3456 149 G 4.9734 7.7812 120.9888 46.0900 0.0000 170.8669 150 A 4.1157 7.7200 121.5553 52.2165 19.0138 177.4374 151 A 4.4314 8.6346 121.3712 51.8349 20.5758 176.4046 152 V 4.8648 9.2366 119.3609 61.0823 34.4758 174.7556 153 K 4.9804 9.3277 126.2238 54.5151 35.9655 174.7124 154 L 4.8224 8.7711 125.6671 54.0656 43.7875 175.2259 155 A 4.8349 7.9819 126.0950 51.2822 23.0905 173.7608 156 D 4.2006 8.7745 121.1330 54.8250 38.4895 172.8626 157 F 4.5374 8.2857 123.5209 56.4317 39.8552 178.3935 158 G 3.7402 7.9150 113.0936 48.4267 0.0000 175.2514 159 L 4.3772 7.5956 115.9346 53.9815 42.4796 176.4545 160 A 4.9683 7.6367 121.2777 52.0311 19.1431 177.1864 161 I 4.7719 8.1574 112.3294 59.3080 41.4491 173.3734 162 E 5.1364 8.7152 122.2470 55.5031 30.9246 175.5469 163 V 4.6693 8.8566 116.1216 59.9704 36.2482 174.6674 164 N 4.7550 8.5190 120.3813 51.6271 39.2172 175.1519 165 D 4.5682 8.5205 115.9478 54.5995 39.6065 175.9454 166 S 4.6209 7.5831 117.2681 57.1824 63.8064 173.9494 167 E 4.1930 8.6963 125.2509 56.4106 30.2569 176.2738 168 A 4.4835 8.1787 122.8862 51.1831 21.9390 174.5765 169 W 4.2510 8.1701 121.6843 56.2897 30.4302 176.6739 170 H 4.1921 6.9741 124.6407 54.3553 27.2640 175.3381 171 G 3.6119 6.8265 108.9697 44.4665 0.0000 171.3962 172 F 4.4346 8.3186 119.4707 56.7105 40.7588 173.4954 173 A 4.0856 7.5726 128.9472 51.1841 21.6875 174.3207 174 G 4.0687 7.9675 105.2413 43.4664 0.0000 173.1814 175 T 4.3395 8.1662 116.6960 61.4101 69.3843 172.8543 176 P 4.5302 0.0000 0.0000 64.6990 31.3074 174.5414 177 G 3.3912 8.3135 117.4748 45.3595 0.0000 173.1659 178 Y 4.7693 7.6745 116.1360 57.5559 39.2612 176.2620 179 L 4.1725 8.0532 120.0653 54.8997 42.6717 176.7775 180 S 3.4969 8.1656 115.9315 56.4379 64.8183 173.2281 181 P 4.0007 0.0000 0.0000 65.8955 31.0409 178.7255 182 E 4.0326 8.0190 115.5231 59.4523 28.9714 178.9465 183 V 4.3486 7.6779 118.4410 65.3368 31.4882 177.7649 184 L 4.3400 7.9113 117.4001 56.7481 41.6912 178.0502 185 K 4.3277 7.9322 116.8653 55.0463 32.0584 176.4399 186 K 3.2978 7.5258 116.7386 57.0491 30.1873 174.8110 187 D 4.7434 7.9016 118.0181 53.3142 41.9725 174.2300 188 P 4.8907 0.0000 0.0000 62.8291 32.2060 175.4889 189 Y 5.0269 8.5965 121.0672 55.6788 42.1916 173.5875 190 S 4.6380 8.5085 114.0372 56.3091 64.4484 174.7084 191 K 3.7928 9.1799 115.0186 59.4504 31.9836 176.5043 192 P 4.4808 0.0000 0.0000 64.3874 31.0608 178.5780 193 V 3.7241 7.7342 111.7193 64.2337 31.2975 178.1272 194 D 4.4270 8.3374 118.8966 57.4068 40.9858 178.6540 195 I 3.7791 7.9626 119.7613 64.0398 37.0235 178.1359 196 W 4.2441 8.3225 128.7937 60.4945 30.5969 177.6120 197 A 4.1977 7.9583 120.7417 55.6068 17.7162 179.0735 198 C 4.0445 8.3046 115.0904 63.2401 28.3010 176.4291 199 G 3.6185 7.8134 106.6163 47.9905 0.0000 175.6117 200 V 3.3114 7.2789 119.5755 65.9788 31.5291 177.9673 201 I 3.7471 7.8836 119.5697 64.3083 36.6119 177.9341 202 L 3.8852 8.7212 121.4473 58.6140 41.7466 178.8802 203 Y 4.1431 7.9637 119.3174 60.5900 38.1385 177.7288 204 I 3.7882 7.8794 122.1410 63.8378 37.2495 178.0501 205 L 3.7754 7.9064 120.0762 58.1799 41.2995 179.9918 206 L 3.9724 7.1677 115.3455 56.9477 41.5245 178.3412 207 V 3.4491 6.4050 107.7129 59.2789 33.5396 176.7467 208 G 3.8725 9.4729 107.3442 46.0894 0.0000 172.6903 209 Y 4.8016 6.4405 116.8966 54.1751 40.7481 173.4857 210 P 4.6631 0.0000 0.0000 61.6956 32.5085 175.4378 211 P 3.8238 0.0000 0.0000 64.9825 31.2822 176.8941 212 F 5.1408 6.8787 115.2057 55.5188 40.6013 175.2014 213 W 4.5885 8.4850 131.4694 56.7605 34.0865 172.7853 214 D 3.7459 7.5703 123.5184 51.8836 44.1037 174.6618 215 E 3.6364 7.8925 121.8793 58.8143 29.7821 177.8292 216 D 4.6015 8.4271 119.3827 52.7442 42.5393 176.2777 217 Q 3.7578 8.7715 127.9988 59.9989 28.9898 178.5725 218 H 4.5159 8.4190 116.2844 58.9834 28.9889 177.4933 219 R 3.9256 8.1839 119.4321 59.9363 29.6810 177.9580 220 L 3.9270 7.8418 120.1710 57.4322 42.0641 178.1282 221 Y 4.1618 7.9767 116.1258 61.3297 37.9605 178.9542 222 A 3.9472 8.2157 121.3167 55.4084 18.4538 179.3012 223 Q 3.8370 7.7665 117.1813 59.6042 29.0592 178.5357 224 I 2.7321 7.8021 120.7816 63.9992 36.9202 178.2178 225 K 3.7483 8.2861 119.0878 59.8719 32.0714 178.9759 226 A 4.1236 7.9464 119.9833 52.8887 18.2928 177.9907 227 G 3.7395 8.2429 104.9269 46.4480 0.0000 174.3800 228 A 4.3323 7.7955 125.1455 50.4172 17.6175 177.0924 229 Y 4.9661 7.3088 118.4074 55.6840 41.4388 174.5038 230 D 4.6643 8.3159 118.9048 52.7483 42.6784 175.2630 231 Y 4.2939 7.7026 115.7423 55.0809 37.5711 173.4617 232 P 4.4925 0.0000 0.0000 62.5495 32.5778 176.6094 233 S 4.7518 8.5734 118.4508 57.7425 63.8130 172.5356 234 P 5.4777 0.0000 0.0000 62.9273 32.6059 177.3990 235 E 3.7294 8.4175 118.8113 59.8578 29.1941 179.0617 236 W 4.2028 8.1734 118.7554 57.5784 29.2687 177.9784 237 D 4.6674 8.5002 120.1608 56.3922 39.9379 177.2008 238 T 4.7863 7.3334 107.8630 61.1112 69.3044 173.4641 239 V 4.4114 7.5265 121.6922 61.6853 33.1413 175.4948 240 T 3.9682 8.9155 117.5689 61.5720 69.2498 173.0180 241 P 4.2402 0.0000 0.0000 66.0398 30.8842 178.2878 242 E 4.1132 8.3993 116.3269 59.3298 29.3664 179.1940 243 A 2.6952 7.8955 120.8768 54.0067 18.6672 179.6093 244 K 3.6663 7.6670 116.4134 59.7411 32.3694 178.9768 245 S 4.1241 8.4142 113.6436 61.8574 62.3030 176.2772 246 L 3.9789 7.4813 121.9599 57.8724 41.7561 179.0913 247 I 3.6871 7.4601 119.4333 64.5919 35.8277 177.8062 248 D 5.1034 9.0342 121.8042 56.9789 40.6318 179.1085 249 S 4.3089 8.0987 112.6102 60.1802 63.2172 175.8817 250 M 4.2573 7.3128 120.5154 56.9464 32.2286 176.8882 251 L 3.8447 7.9891 117.8394 53.6490 42.9867 176.7871 252 T 4.1978 7.0068 117.1911 63.6609 68.6837 175.1967 253 V 3.6888 8.6712 127.1035 65.4957 32.0328 175.2423 254 N 4.5453 8.1290 118.8593 52.3283 38.5137 172.9678 255 P 4.3284 0.0000 0.0000 65.7609 31.5935 179.0229 256 K 3.9302 8.3827 115.3146 58.8715 31.9563 177.6497 257 K 4.4912 8.0914 115.2017 55.8326 32.6754 175.5398 258 R 4.3452 7.9738 121.2058 55.3608 30.4802 175.8199 259 I 3.9565 7.9615 126.7422 61.8390 38.9032 175.1859 260 T 4.4725 8.6789 117.9418 60.5804 71.2203 175.7052 261 A 4.0101 8.7732 122.6286 55.5882 18.2767 179.4478 262 D 4.5107 8.1459 114.9948 56.6750 41.1926 178.1592 263 Q 4.3205 7.6424 117.1434 58.0093 29.5180 177.7037 264 A 4.1134 8.0910 121.7714 55.0719 18.2182 179.2068 265 L 4.2988 7.8838 115.4885 56.3051 41.7104 177.9038 266 K 4.5062 7.6072 117.4609 55.8965 32.7031 176.1544 267 V 4.0463 7.7398 119.9740 61.5771 32.3796 174.8307 268 P 4.1515 0.0000 0.0000 65.9303 31.3665 177.8249 269 W 4.3617 8.3494 125.1452 58.9567 30.6904 176.1698 270 I 4.3819 8.3286 116.9625 62.9004 38.9807 175.7318 271 C 4.5351 7.9825 116.5062 59.7213 27.8308 173.5648 272 N 4.7476 8.0759 120.6983 52.2256 38.7637 174.4969 273 R 4.2679 8.2569 124.2125 55.2973 29.5274 175.0185 274 E 4.2012 8.4177 119.0631 55.8776 29.6662 174.1275 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 8 K 8.31 4.51 0.00 1.76 1.93 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.46 7.81 9 F 8.59 4.46 0.00 2.66 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 10 S 9.26 4.17 0.00 3.93 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 11 D 8.15 4.43 0.00 2.78 2.66 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 12 N 8.04 4.55 0.00 1.94 2.29 0.00 0.00 7.13 6.79 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 13 Y 7.05 4.67 0.00 1.43 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 14 D 8.50 4.89 0.00 2.77 2.51 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 0.00 0.00 0.00 0.00 15 V 8.68 4.15 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 0.93 0.00 0.00 1.23 0.00 0.00 16 K 8.25 4.88 0.00 1.66 1.59 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.53 7.81 17 E 8.73 4.44 0.00 2.02 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 0.00 2.38 2.27 0.00 18 E 8.57 5.10 0.00 2.23 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 2.16 2.26 0.00 19 L 7.75 5.20 0.00 1.76 1.78 0.92 1.24 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 *25 S 8.22 4.56 0.00 3.79 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 26 V 7.54 4.05 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 0.65 0.00 0.00 0.90 0.00 0.00 27 V 7.73 5.04 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 0.91 0.00 0.00 0.89 0.00 0.00 28 R 7.99 4.60 0.00 2.05 1.96 0.00 2.73 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 29 R 8.61 4.93 0.00 2.01 1.93 0.00 3.23 0.00 0.00 3.36 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 30 C 7.99 5.88 0.00 3.29 3.23 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 31 V 7.67 4.88 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 0.92 0.00 0.00 0.93 0.00 0.00 32 H 8.61 4.23 0.00 3.34 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.96 3.46 0.00 1.79 1.54 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.33 7.81 34 T 7.50 3.82 4.07 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 1.17 0.00 0.00 35 T 7.74 4.03 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 1.24 0.00 0.00 36 G 7.95 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.09 4.18 0.00 1.27 1.09 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.63 4.16 0.00 1.77 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 39 F 9.53 5.47 0.00 2.97 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 40 A 9.27 4.91 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 41 A 9.12 5.10 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 42 K 9.09 4.14 0.00 1.93 1.89 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.40 7.81 43 I 8.77 4.49 1.50 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.72 -0.04 0.00 0.00 44 I 8.40 4.49 1.96 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 1.11 0.66 1.03 0.00 0.00 45 N 8.67 5.76 0.00 2.81 2.75 0.00 0.00 6.73 7.70 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 46 T 8.07 4.30 4.17 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 1.11 0.00 0.00 *53 D 8.75 4.70 0.00 2.80 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 54 F 8.17 4.06 0.00 3.02 3.03 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 55 Q 8.12 4.26 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 56 K 7.82 4.19 0.00 2.01 1.81 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.48 7.81 57 L 7.50 4.07 0.00 1.31 1.49 0.82 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.94 3.63 0.00 1.98 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 2.32 2.36 0.00 59 R 7.83 3.79 0.00 1.89 1.90 0.00 3.25 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 60 E 7.74 3.91 0.00 2.01 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 2.35 2.40 0.00 61 A 8.31 4.08 1.30 0.00 0.00 0.00 0.00 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2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.64 4.16 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 0.00 113 S 8.63 3.66 0.00 2.72 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 0.00 114 H 8.41 4.08 0.00 3.17 3.42 0.00 5.84 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 C 8.47 4.12 0.00 3.36 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 0.00 116 I 8.25 3.85 2.12 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 1.49 1.11 1.18 0.00 0.00 117 Q 8.20 4.02 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 118 Q 7.84 3.96 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 119 I 7.38 3.70 1.97 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 1.50 0.78 0.87 0.00 0.00 120 L 8.56 3.96 0.00 1.88 1.77 0.99 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.28 3.95 0.00 2.21 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 0.00 2.40 2.38 0.00 122 S 8.12 4.00 0.00 4.10 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 0.00 123 I 8.21 3.56 2.07 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 1.57 0.95 0.82 0.00 0.00 124 A 8.62 4.01 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 7.94 4.05 0.00 2.96 3.06 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 0.00 126 C 8.42 3.90 0.00 3.20 3.20 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 0.00 127 H 8.45 4.45 0.00 3.28 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.48 4.37 0.00 3.97 4.10 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 0.00 129 N 6.98 4.82 0.00 2.55 2.61 0.00 0.00 6.95 7.53 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 0.00 130 G 8.84 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 7.91 4.84 2.04 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 1.35 0.94 1.04 0.00 0.00 132 V 8.34 4.57 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 1.02 0.00 0.00 0.96 0.00 0.00 133 H 9.65 3.95 0.00 3.08 3.35 0.00 5.86 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 R 8.59 4.34 0.00 1.95 2.01 0.00 3.06 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 135 N 7.64 4.57 0.00 2.60 2.75 0.00 0.00 6.90 7.78 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 0.00 136 L 7.66 3.97 0.00 1.41 1.47 0.70 0.53 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 0.00 137 K 7.69 3.85 0.00 1.13 0.74 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.29 7.81 138 P 0.00 4.19 0.00 2.41 2.17 0.00 3.46 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.12 0.00 139 E 8.17 4.37 0.00 1.84 1.85 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 1.83 2.22 0.00 140 N 8.22 4.96 0.00 2.58 2.69 0.00 0.00 6.82 6.77 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 0.00 141 L 8.05 5.03 0.00 1.56 1.53 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 142 L 9.04 5.14 0.00 1.54 1.56 0.90 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.47 5.09 0.00 1.62 1.77 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 144 A 9.10 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 0.00 145 S 7.62 4.73 0.00 3.92 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 0.00 146 K 8.41 4.37 0.00 1.75 1.83 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.53 7.81 147 A 7.75 4.07 1.24 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 0.00 0.00 0.00 148 K 8.54 4.24 0.00 1.62 1.67 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.36 7.81 149 G 7.78 4.97 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 0.00 0.00 0.00 150 A 7.72 4.12 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.63 4.43 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 0.00 152 V 9.24 4.86 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 1.00 0.00 0.00 0.95 0.00 0.00 153 K 9.33 4.98 0.00 1.66 1.68 0.00 1.84 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.52 7.81 154 L 8.77 4.82 0.00 1.91 1.64 0.76 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 155 A 7.98 4.83 1.14 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 0.00 0.00 156 D 8.77 4.20 0.00 2.71 2.66 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 0.00 157 F 8.29 4.54 0.00 3.03 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 0.00 158 G 7.92 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 7.60 4.38 0.00 1.56 1.64 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 160 A 7.64 4.97 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 0.00 161 I 8.16 4.77 1.87 0.00 0.00 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 1.40 0.74 0.99 0.00 0.00 162 E 8.72 5.14 0.00 1.99 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 2.22 2.33 0.00 163 V 8.86 4.67 2.06 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 0.64 0.00 0.00 0.98 0.00 0.00 164 N 8.52 4.75 0.00 2.95 2.99 0.00 0.00 5.74 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 0.00 165 D 8.52 4.57 0.00 2.80 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 0.00 166 S 7.58 4.62 0.00 4.00 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 0.00 167 E 8.70 4.19 0.00 1.99 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 2.38 2.35 0.00 168 A 8.18 4.48 1.01 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 0.00 0.00 169 W 8.17 4.25 0.00 3.20 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 0.00 170 H 6.97 4.19 0.00 3.07 3.19 0.00 6.03 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 0.00 171 G 6.83 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 0.00 172 F 8.32 4.43 0.00 3.23 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 7.57 4.09 1.11 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 0.00 0.00 174 G 7.97 4.07 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 0.00 0.00 0.00 175 T 8.17 4.34 4.50 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 1.39 0.00 0.00 176 P 0.00 4.53 0.00 1.98 1.95 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 177 G 8.31 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 0.00 0.00 0.00 178 Y 7.67 4.77 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.05 4.17 0.00 1.76 1.69 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 180 S 8.17 3.50 0.00 3.97 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 0.00 181 P 0.00 4.00 0.00 1.84 1.88 0.00 2.24 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.38 0.00 182 E 8.02 4.03 0.00 2.29 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 0.00 2.41 2.47 0.00 183 V 7.68 4.35 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 1.16 0.00 0.00 0.53 0.00 0.00 184 L 7.91 4.34 0.00 1.79 1.76 1.23 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 185 K 7.93 4.33 0.00 1.89 1.79 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.69 7.81 186 K 7.53 3.30 0.00 1.33 0.76 0.00 1.40 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.18 1.22 7.81 187 D 7.90 4.74 0.00 2.90 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 0.00 188 P 0.00 4.89 0.00 1.97 1.96 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 189 Y 8.60 5.03 0.00 2.97 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 0.00 190 S 8.51 4.64 0.00 3.90 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 0.00 191 K 9.18 3.79 0.00 1.74 1.51 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.53 7.81 192 P 0.00 4.48 0.00 2.23 2.17 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 193 V 7.73 3.72 1.89 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 0.48 0.00 0.00 0.90 0.00 0.00 194 D 8.34 4.43 0.00 3.00 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 0.00 195 I 7.96 3.78 1.99 0.00 0.00 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 1.09 0.00 0.00 196 W 8.32 4.24 0.00 3.57 3.34 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 0.00 197 A 7.96 4.20 1.45 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 0.00 0.00 198 C 8.30 4.04 0.00 3.19 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 0.00 199 G 7.81 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 0.00 0.00 0.00 200 V 7.28 3.31 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 0.98 0.00 0.00 0.92 0.00 0.00 201 I 7.88 3.75 1.99 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.73 0.87 0.00 0.00 202 L 8.72 3.89 0.00 1.74 1.82 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 7.96 4.14 0.00 3.03 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 0.00 204 I 7.88 3.79 2.00 0.00 0.00 1.00 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 1.53 0.80 0.00 0.00 205 L 7.91 3.78 0.00 1.73 1.58 0.88 0.16 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 0.00 206 L 7.17 3.97 0.00 1.07 1.09 0.83 0.96 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 0.00 207 V 6.41 3.45 0.68 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 -0.78 0.00 0.00 0.12 0.00 0.00 208 G 9.47 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 Y 6.44 4.80 0.00 3.03 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 0.00 210 P 0.00 4.66 0.00 2.16 2.02 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.09 0.00 211 P 0.00 3.82 0.00 0.49 0.49 0.00 3.36 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.45 0.00 212 F 6.88 5.14 0.00 3.12 2.95 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 0.00 213 W 8.48 4.59 0.00 3.23 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 0.00 214 D 7.57 3.75 0.00 2.37 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 0.00 0.00 0.00 0.00 215 E 7.89 3.64 0.00 1.81 1.89 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 2.00 2.20 0.00 216 D 8.43 4.60 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.77 3.76 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.81 2.28 0.00 218 H 8.42 4.52 0.00 3.32 3.41 0.00 5.90 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 0.00 219 R 8.18 3.93 0.00 1.99 1.90 0.00 3.27 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.71 0.00 220 L 7.84 3.93 0.00 1.52 1.48 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 221 Y 7.98 4.16 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 0.00 222 A 8.22 3.95 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 0.00 223 Q 7.77 3.84 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 224 I 7.80 2.73 1.96 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 1.33 0.39 0.79 0.00 0.00 225 K 8.29 3.75 0.00 1.88 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.47 7.81 226 A 7.95 4.12 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 0.00 227 G 8.24 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 A 7.80 4.33 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 0.00 229 Y 7.31 4.97 0.00 2.68 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 0.00 230 D 8.32 4.66 0.00 2.65 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 Y 7.70 4.29 0.00 2.80 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 P 0.00 4.49 0.00 2.57 2.08 0.00 3.91 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 233 S 8.57 4.75 0.00 3.93 4.01 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 0.00 234 P 0.00 5.48 0.00 2.28 2.34 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 235 E 8.42 3.73 0.00 1.71 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 0.00 2.78 2.44 0.00 236 W 8.17 4.20 0.00 3.61 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 D 8.50 4.67 0.00 2.85 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 0.00 238 T 7.33 4.79 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 1.21 0.00 0.00 239 V 7.53 4.41 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.50 0.00 0.00 240 T 8.92 3.97 4.54 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 1.42 0.00 0.00 241 P 0.00 4.24 0.00 2.20 2.19 0.00 3.66 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 242 E 8.40 4.11 0.00 2.14 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 2.51 2.52 0.00 243 A 7.90 2.70 0.62 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 0.00 244 K 7.67 3.67 0.00 1.94 1.95 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.66 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.86 1.39 7.81 245 S 8.41 4.12 0.00 3.83 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 0.00 246 L 7.48 3.98 0.00 1.70 1.50 0.97 1.07 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 0.00 247 I 7.46 3.69 2.02 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 0.72 0.00 0.00 248 D 9.03 5.10 0.00 2.89 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 0.00 249 S 8.10 4.31 0.00 4.12 4.30 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 0.00 250 M 7.31 4.26 0.00 2.19 2.13 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 2.80 2.58 0.00 251 L 7.99 3.84 0.00 1.42 1.62 -0.33 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 252 T 7.01 4.20 4.51 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 0.00 0.00 0.00 1.40 0.00 0.00 253 V 8.67 3.69 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 1.12 0.00 0.00 254 N 8.13 4.55 0.00 2.87 2.76 0.00 0.00 7.20 7.71 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 0.00 255 P 0.00 4.33 0.00 2.26 2.18 0.00 3.70 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.48 0.00 256 K 8.38 3.93 0.00 1.95 1.93 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.46 7.81 257 K 8.09 4.49 0.00 1.75 1.84 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.36 7.81 258 R 7.97 4.35 0.00 2.12 2.09 0.00 3.57 0.00 0.00 3.49 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.97 0.00 259 I 7.96 3.96 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.17 1.03 0.00 0.00 260 T 8.68 4.47 4.29 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 1.33 0.00 0.00 261 A 8.77 4.01 1.41 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 0.00 0.00 262 D 8.15 4.51 0.00 2.70 2.79 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 0.00 0.00 0.00 0.00 263 Q 7.64 4.32 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 264 A 8.09 4.11 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 0.00 265 L 7.88 4.30 0.00 1.71 1.78 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 266 K 7.61 4.51 0.00 1.91 1.84 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.58 7.81 267 V 7.74 4.05 2.21 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 1.11 0.00 0.00 1.09 0.00 0.00 268 P 0.00 4.15 0.00 2.33 2.16 0.00 3.73 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 269 W 8.35 4.36 0.00 3.20 3.22 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 0.00 270 I 8.33 4.38 2.05 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.43 0.95 0.00 0.00 271 C 7.98 4.54 0.00 3.12 2.95 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 0.00 272 N 8.08 4.75 0.00 2.64 2.70 0.00 0.00 6.82 7.66 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 0.00 273 R 8.26 4.27 0.00 1.80 1.72 0.00 3.42 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.15 0.00 274 E 8.42 4.20 0.00 2.11 1.79 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 0.00 2.14 1.85 0.00 * Residues marked with a * may have inaccurate shift predictions.