NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.3966 8.3549 109.5989 45.1074 0.0000 173.2445 *2 E 4.1252 8.1167 117.4747 55.7554 31.7805 177.1799 3 R 3.9551 8.4863 120.0443 59.6994 30.1708 179.3025 4 A 4.0052 8.0132 119.6381 55.0964 18.5537 179.4149 5 A 3.9900 7.9716 118.9147 55.2300 18.5685 179.4909 6 F 4.1410 8.6397 119.5718 61.1416 39.4331 177.5440 7 G 3.7515 8.3184 106.9230 47.3279 0.0000 175.8831 8 K 4.0650 8.1206 121.0819 58.6781 31.8784 179.4046 9 L 3.8740 7.6218 120.7912 58.0301 41.9659 179.0290 10 V 3.5242 7.4004 118.1841 65.9619 31.4364 177.6064 11 Q 4.0851 8.0855 118.9448 59.3106 28.6953 178.2521 12 A 4.0432 7.7732 120.1884 55.1869 18.7315 179.2932 13 L 4.0870 8.1854 117.7096 57.8368 41.6741 179.6292 14 R 3.9616 8.2666 118.8759 59.6135 29.9118 178.4295 15 R 4.2211 7.9304 114.9532 57.8022 30.2076 177.8320 16 E 4.1652 7.7764 117.3033 57.0652 30.4059 175.9290 17 H 4.6184 7.2994 116.8666 54.1791 31.0366 174.3264 18 R 5.3106 8.0823 118.7646 54.6663 34.3835 174.7259 19 D 4.9381 9.2686 125.0054 52.5835 41.6763 177.5175 20 E 4.0436 9.1969 116.5195 59.7491 29.4300 175.9107 21 K 4.3735 8.2840 117.2154 54.1541 31.8156 179.5715 22 G 3.9992 8.5167 106.5767 47.2548 0.0000 173.8302 23 R 4.4782 8.4889 119.5029 54.5270 31.6486 176.4019 24 V 4.2247 8.4662 123.7218 62.6844 32.3430 175.6487 25 W 4.5850 8.7182 127.8794 57.4902 29.6729 176.4560 26 T 4.5028 8.5206 114.6683 60.2727 70.5241 175.6081 27 Q 4.0618 8.5657 119.7962 59.0681 28.4690 178.8530 28 E 3.9343 8.1231 119.1955 59.3653 29.4913 179.4528 29 V 3.3048 7.4824 117.9099 65.8199 31.5616 177.8487 30 L 3.7683 7.9559 119.8666 57.8826 41.9213 178.6558 31 A 3.9618 8.3544 121.2208 55.1097 18.1672 179.1728 32 E 3.7860 8.1617 117.6966 59.6750 29.5402 179.3673 33 R 3.8203 7.7706 116.8993 58.8341 30.1282 178.3781 34 T 4.2348 7.9231 107.6969 61.1703 69.5038 174.7283 35 Q 3.5472 7.5648 119.5396 57.1561 26.7493 173.1765 36 L 4.8148 7.5460 115.9458 52.0389 44.6062 175.2515 37 P 4.4304 0.0000 0.0000 62.1218 32.1996 177.5271 38 K 3.8725 8.7847 122.1205 59.8925 31.9384 178.9833 39 R 3.8968 8.0431 118.3070 59.8298 29.8824 178.5144 40 T 3.9044 7.8402 114.9583 66.6638 68.3977 176.8126 41 I 3.7511 7.7246 121.2853 64.2372 37.1764 177.8636 42 E 3.9356 8.5318 120.5054 59.5488 29.4276 179.2248 43 R 4.0866 8.1303 119.4171 58.5649 29.9734 179.1518 44 I 3.7807 8.0075 119.7671 64.6307 36.6866 178.4498 45 E 4.2396 8.5129 119.4225 59.1218 29.0565 178.5329 46 N 4.6654 8.2293 114.8317 53.0222 38.9237 175.5074 47 G 3.9209 7.6868 108.2723 46.8459 0.0000 174.1874 48 S 4.6450 8.3850 112.0443 57.3454 63.2408 172.9143 49 L 4.8541 7.6792 120.6309 53.2303 42.9547 176.2063 50 A 4.0851 8.8832 127.5291 54.6529 18.6419 176.7502 51 H 4.8148 8.0366 113.8678 54.2355 31.7958 173.4532 52 L 4.3610 7.9687 126.8268 52.5457 41.7112 175.8569 53 D 4.2258 8.3465 122.4007 54.6247 42.6678 176.6761 54 A 3.9202 8.6342 127.6983 55.3048 18.3910 179.4424 55 D 4.2628 8.2677 116.3185 57.4926 41.2619 178.4281 56 I 3.7583 7.7463 119.7453 64.5389 37.1266 178.1606 57 L 4.3323 7.9878 119.6202 58.0148 41.4705 179.7076 58 L 4.2871 8.1702 118.8403 57.9298 41.4906 179.7493 59 R 4.0037 8.2625 118.0233 59.2188 29.9497 179.1496 60 L 4.0483 8.4366 118.6564 57.8980 41.6046 179.4485 61 A 3.5873 8.4698 120.8371 55.0118 18.2495 179.4941 62 D 4.2964 8.4165 117.1730 57.6294 40.7801 178.9167 63 A 4.1418 8.0590 119.9930 54.9782 18.5150 178.8970 64 L 4.0467 8.0480 114.6892 54.2990 42.6233 176.5445 65 E 3.7523 7.7672 117.4764 57.2182 27.4867 175.1200 66 L 4.1503 7.3046 117.4484 54.5207 42.7360 178.5904 67 T 4.1393 8.6730 113.3645 61.1372 70.9991 175.9231 68 I 3.7644 8.2561 122.0871 64.6474 36.9747 178.8830 69 G 3.6409 8.0137 105.8866 47.8579 0.0000 175.4463 70 E 3.9387 7.9755 120.6678 59.0487 29.3739 179.4760 71 R 3.4260 8.1318 118.5225 59.1012 30.1813 178.9858 72 R 4.0334 7.7688 117.7554 59.7104 30.1152 178.4721 73 E 4.1281 8.0137 118.3191 59.2527 29.2884 179.1874 74 F 4.2920 8.6351 121.2436 61.4320 39.3990 177.3467 75 F 4.5040 8.4842 117.9440 60.5822 38.6599 177.5321 76 F 4.2558 8.5240 120.1592 61.2089 38.9685 177.1068 77 A 3.9146 8.1547 119.4506 54.6856 18.1754 179.0826 78 A 3.1740 7.2247 118.7780 54.1863 18.8566 178.9620 79 T 4.3035 7.7355 105.7859 60.7556 70.2919 175.4283 80 G 3.1502 7.2133 111.4762 45.7655 0.0000 173.1467 81 I 3.8517 8.1759 125.1863 60.9534 37.8073 175.5159 82 I 4.2044 8.0257 126.2683 60.0258 38.1939 175.7400 83 E 4.1972 8.6237 126.8101 56.6986 30.2324 177.8382 84 Q 4.1397 8.6542 120.7123 57.6745 28.5005 177.8716 85 K 4.3460 7.7064 117.1381 55.7324 33.7296 176.9460 86 S 4.2352 8.4012 118.0123 57.9015 63.5341 174.0702 87 A 3.9134 8.4018 126.6178 52.5224 18.6871 177.0695 88 T 4.4413 7.8056 111.2860 59.7593 71.1181 173.3867 89 Y 4.8311 8.0262 120.6741 55.8096 41.4550 175.5192 90 K 4.0603 9.0745 125.3030 58.8137 32.5448 176.9886 91 R 4.7268 7.5804 115.2607 53.7354 33.0624 176.1413 92 S 4.4563 8.5674 116.1776 57.2403 65.1467 173.6339 93 P 4.4155 0.0000 0.0000 66.3843 30.7256 178.3216 94 E 4.0995 8.2034 117.8105 59.3238 29.5030 179.1603 95 E 4.1059 8.1536 117.9440 59.3089 29.4091 179.7236 96 S 4.1361 8.3877 115.6256 61.4614 62.8401 176.4380 97 L 3.8425 8.0363 123.0958 58.1567 41.8337 178.7343 98 Q 3.9645 8.3028 119.5878 59.2763 28.7169 177.6459 99 Y 4.0730 7.8912 119.9283 60.6375 38.9188 177.6903 100 L 4.0287 7.6748 118.5600 57.6220 41.9854 179.2035 101 I 3.8796 7.9810 120.0162 64.4116 35.9047 179.1171 102 D 4.5062 8.1401 116.7682 55.3089 40.3569 178.3994 *104 I 4.3091 7.6783 122.2923 61.3656 39.0662 177.1640 105 R 4.3839 7.9574 119.0113 58.5353 30.5174 176.8876 106 N 4.5602 7.1658 117.5481 52.1253 37.2682 175.0359 *108 N 4.6696 7.6355 110.3391 52.2377 39.4037 174.8415 109 V 4.1021 7.2331 110.1966 58.5918 35.5471 173.4421 110 P 4.4721 0.0000 0.0000 63.0636 32.2263 175.4739 111 A 5.3286 9.1311 124.7551 50.9392 22.9473 174.9348 112 F 5.2449 8.6219 115.4127 55.8826 41.7588 173.5254 113 V 4.8287 9.2177 119.6756 61.3171 34.2628 174.3872 114 T 5.8402 9.1433 116.6448 59.3263 72.6580 173.2864 115 D 5.0084 8.2377 122.1216 51.9293 41.9316 176.5459 116 Q 4.0307 8.8226 115.5631 59.1210 28.6159 176.2546 117 Y 4.8558 8.2369 114.1273 57.2286 38.8016 175.3278 118 V 3.6414 8.1003 119.2616 64.0536 30.7253 171.2442 119 N 4.9907 8.8473 115.3337 52.4663 39.4286 174.6150 120 I 4.1945 8.9955 124.1011 61.3324 37.8183 176.6569 121 I 4.1007 9.1395 129.1891 63.5225 38.5992 175.9123 122 A 5.0958 7.7506 120.4167 51.1430 22.7208 175.0897 123 A 5.2529 8.7056 120.4544 49.5302 23.6380 175.9778 124 N 5.4812 8.8605 124.6353 51.9613 36.5429 177.4098 *126 I 4.1524 8.5954 116.4313 61.5924 39.1376 177.4789 127 T 3.9407 8.1397 116.4701 66.8035 68.2704 176.6527 128 I 3.7614 7.3657 120.4674 64.5108 37.1772 178.8303 129 R 3.9353 7.9438 118.2236 59.1895 29.8416 178.5464 130 F 4.1365 8.3702 119.8335 61.3843 39.2895 176.2364 131 F 4.2176 8.2394 116.1705 57.6600 39.5346 174.7764 132 N 4.1970 7.6655 118.3426 54.4775 37.4128 174.3734 133 I 4.0392 7.7519 118.4041 60.1222 38.9476 176.9790 134 P 4.5430 0.0000 0.0000 62.1704 31.5649 176.8316 *136 E 4.3156 8.7503 116.9376 57.4812 31.3532 178.0514 137 L 3.9853 7.7280 118.3004 57.6834 41.2913 179.6387 138 I 3.6879 7.5449 118.6228 64.4246 37.2559 177.9086 139 E 4.1410 8.1851 118.0825 58.6343 29.5404 178.2295 140 T 4.3532 7.6257 107.2351 61.6415 69.5528 176.3304 141 A 3.6403 7.4436 124.6598 54.7499 18.0135 177.8851 142 P 4.4199 0.0000 0.0000 65.0366 31.5253 177.9074 143 L 4.2393 7.4188 116.3527 54.6766 42.3531 176.5809 144 L 4.8178 7.0410 119.2421 51.8993 44.6315 175.7083 145 P 4.4049 0.0000 0.0000 65.2865 31.6427 176.8851 146 H 4.8577 8.2295 111.4663 54.9088 28.9571 176.1504 147 G 3.8705 7.6033 110.5406 48.0136 0.0000 174.3585 148 Y 4.6161 7.8198 114.4703 57.2503 38.2995 174.8126 149 N 5.1496 7.9312 119.6962 52.5610 39.7515 176.9743 150 L 3.7377 8.5998 127.6188 54.8489 41.6918 179.0266 *152 R 4.1501 8.1464 118.8179 55.9626 31.9223 177.4125 153 V 3.3892 7.3401 115.4957 65.9433 31.6898 177.3791 154 V 3.4507 7.5350 118.0541 65.2548 31.2913 176.6258 155 F 4.9433 7.9801 114.9294 57.3986 40.4325 176.1269 156 G 2.6932 7.5790 109.7450 45.2090 0.0000 173.6637 157 T 4.2148 7.3353 108.5671 62.8266 69.6299 176.4435 158 E 4.0856 8.2148 121.4752 58.3522 29.7886 176.3277 159 Y 4.6863 7.7148 118.5744 55.7240 40.9444 175.3040 160 D 4.3708 7.7225 127.5963 52.8511 40.1925 175.7034 161 F 4.2335 7.9220 126.0771 60.4098 39.8542 175.9560 162 R 3.2505 7.3943 118.0684 59.2431 29.3375 178.2215 163 R 3.6957 7.1216 115.9887 59.1059 30.0349 178.5128 164 V 3.4862 6.9428 116.7430 65.8728 31.7624 177.9282 165 V 3.1226 7.1899 108.2780 59.6581 32.2114 177.9575 166 G 3.7209 8.1527 107.9378 46.7944 0.0000 176.8404 167 T 4.1550 8.4520 111.0015 60.9107 67.1314 173.9083 *169 W 4.9745 7.6753 134.5802 58.2581 33.2423 175.9201 170 D 4.2601 8.3306 116.5520 57.4701 40.5312 178.0472 171 E 3.9327 8.0992 118.8219 59.3727 29.7538 178.7575 172 V 2.9342 7.5707 117.4277 65.7748 31.4473 177.6814 173 A 3.1915 7.2564 119.5677 54.6648 17.8929 179.4960 174 R 4.1104 7.6483 115.8670 59.6171 30.4698 178.4817 175 H 4.3575 8.1120 117.8238 59.2227 29.8605 178.7214 176 N 4.6557 8.0041 117.2173 53.5242 38.3450 177.1878 *178 Q 4.2342 8.0837 120.9878 56.1577 31.0491 177.7111 179 L 3.9674 8.0831 117.6382 57.8144 41.6510 179.1402 180 F 4.3528 8.5219 120.4511 61.8268 39.1373 177.5094 181 R 3.8362 8.0857 115.3429 58.9699 30.3505 178.4480 182 A 4.1072 8.0749 120.7040 54.9569 18.2527 179.8049 183 I 3.7493 7.8201 117.9317 64.5419 37.6088 178.6241 184 S 4.0704 7.9258 114.2702 59.9850 62.2973 175.7628 185 L 3.7482 7.2045 123.9594 58.7335 41.5001 179.2642 186 R 4.1264 7.9337 115.2950 58.0851 30.3052 178.1918 187 V 4.3854 7.3887 111.3841 61.1548 32.0648 178.0171 188 R 3.3680 7.4069 119.6964 58.6948 29.9424 177.7738 189 A 4.3329 7.8531 118.4439 53.0485 19.3688 177.7650 190 D 4.7091 8.1205 117.9550 53.9182 42.3217 177.3212 191 G 3.8057 8.9686 111.1090 48.3287 0.0000 175.0945 192 Y 3.9949 8.0200 121.2464 60.2805 38.8502 177.7381 193 F 3.6616 8.1721 121.0928 61.0577 39.6184 176.9072 194 V 3.5011 7.8929 117.8660 66.0630 31.3058 177.6367 195 E 3.6983 7.8708 118.8490 58.9348 29.4753 178.3988 196 L 3.4773 7.3482 120.6761 57.9215 41.8341 178.6831 197 L 3.4109 7.1913 118.9542 57.9889 41.9890 178.0317 198 D 4.1923 7.3523 116.7283 57.3467 41.1442 177.7405 199 N 4.1542 7.3443 115.6543 55.5796 38.9025 178.1761 200 L 3.7577 7.2134 121.7574 54.3047 41.1898 178.9358 *202 Q 3.9923 8.0978 118.3374 55.5740 31.0143 175.8356 203 Y 4.6331 7.6351 117.3071 56.8391 38.8043 175.7545 204 R 4.0124 8.9616 125.6897 60.0133 30.2982 178.1933 205 E 4.4501 8.5096 117.5344 59.1274 29.5382 178.8821 206 F 3.1473 8.5309 120.5125 60.9249 39.5758 176.7056 207 K 3.9381 8.3281 119.2463 59.5957 32.0847 178.4649 208 R 3.8772 8.0935 118.7280 59.7675 29.9422 178.5781 209 F 4.0321 8.2334 117.0789 59.6553 38.6412 177.7437 210 W 3.8542 7.9640 127.7934 60.5712 30.6559 177.8091 211 E 4.1656 8.2980 116.4396 58.6973 29.1482 178.7066 212 R 4.1641 7.5674 116.2239 57.4631 30.3453 178.1654 213 A 3.9320 7.5574 121.3679 55.6363 18.0681 179.2984 214 H 4.1919 8.0271 111.0372 58.1538 28.7441 177.0690 215 L 4.0663 7.3850 120.7723 55.4920 41.6968 177.0336 216 E 4.0783 7.3483 120.0267 56.5553 29.6491 176.9606 217 T 4.3012 8.4722 113.1808 61.8879 69.9203 174.3017 218 E 4.6312 7.9504 121.8261 54.4640 31.6915 174.3660 219 D 5.0343 8.6292 122.8975 52.9225 42.7677 175.8242 220 T 4.6667 9.6206 115.5114 61.0939 70.2595 175.9263 221 S 4.0509 8.3338 116.6994 61.1160 62.8349 175.0852 222 A 4.6459 7.9546 120.6287 51.4490 18.9981 175.7327 223 E 4.8588 7.9587 116.4532 55.0425 33.3476 175.7684 224 N 4.7849 8.5396 117.9883 53.4987 40.2801 173.5684 225 F 4.8497 8.7032 124.1018 56.1826 41.8540 174.1702 226 W 5.0490 8.0305 135.0000 56.4442 31.2404 174.7910 227 Y 4.5863 9.5010 127.1508 57.6957 38.8101 175.2449 228 Q 5.0947 8.8848 123.2172 55.1128 31.7521 173.4016 229 Y 4.9125 8.5058 121.6054 56.2640 42.2354 174.4156 230 T 4.6472 8.5730 117.3552 62.2923 68.8032 174.5221 231 H 4.6050 9.2130 128.4523 55.0542 30.4355 174.6621 232 P 4.3657 0.0000 0.0000 64.7160 31.4386 176.9479 233 V 4.0775 7.7697 117.0232 64.0259 33.1818 175.5845 234 Y 4.5743 7.8150 114.2807 57.5722 39.1925 177.4540 235 G 3.7964 8.0140 108.5515 44.8894 0.0000 172.5450 236 L 4.3812 8.5662 124.1649 55.4047 42.4835 176.9998 237 L 4.9461 8.5279 125.6829 53.1603 46.0480 176.0312 238 S 5.1412 9.1466 116.7987 57.7368 65.7109 172.3855 239 Y 5.4706 9.2599 124.8106 55.9812 41.8434 173.7277 240 V 5.1868 8.9535 120.6369 60.0472 34.2453 174.4579 241 S 4.8754 9.4259 119.7610 57.1523 64.9971 173.0999 242 S 5.4844 8.6804 120.2528 55.7254 65.9269 172.9531 243 R 4.6151 8.4994 123.4915 54.6521 32.1613 174.6046 244 S 4.8240 8.5078 122.1624 56.8404 65.5431 172.7741 245 Q 5.1718 8.6336 124.7246 54.2214 31.5830 174.4784 246 I 4.7979 8.7910 118.7592 58.4900 40.7617 172.6956 247 P 5.0689 0.0000 0.0000 62.4568 32.6367 175.1285 248 T 4.0009 7.7542 111.1493 59.6138 72.0650 174.5535 249 S 4.2399 7.6138 115.8523 58.0203 62.2624 174.0977 *251 G 3.8092 7.8894 108.7867 45.8776 0.0000 172.4895 252 L 4.6889 8.2658 119.4717 55.8320 41.5224 176.3721 253 L 4.7494 8.7719 119.1485 53.4093 45.6313 176.1276 254 S 5.5145 8.6501 119.8832 56.5625 67.0046 171.8882 *256 H 4.8071 8.6250 117.1006 56.7442 29.9831 172.7778 257 T 5.0513 8.4430 112.6402 59.9572 72.5267 172.5768 258 Y 5.0615 8.4459 120.1826 56.5450 40.4289 175.2061 259 I 4.5283 8.8460 127.0360 59.1587 38.8220 173.9807 260 P 4.6608 0.0000 0.0000 62.5045 32.1413 175.9766 261 L 5.0027 8.9410 121.6936 54.0700 43.4714 176.3907 262 S 4.6926 7.9026 111.9798 55.2434 65.9031 173.1106 263 P 4.1569 0.0000 0.0000 65.8677 31.0028 178.9128 264 A 3.9338 7.8848 119.0856 55.3867 18.2991 179.7116 265 T 3.4757 7.6629 113.8582 66.6709 68.3820 177.1670 266 T 3.7080 7.8750 117.8232 66.8047 68.4922 176.4151 267 D 4.2856 8.1687 120.8437 57.0332 40.7723 178.5798 268 L 3.8263 7.8055 120.7963 58.2924 42.0877 179.1197 269 F 4.3387 8.0520 117.5763 60.4735 38.5501 177.5057 270 A 3.9907 8.0518 119.7307 55.0098 18.2485 179.2973 271 K 4.0305 7.9626 117.0500 59.7641 32.4000 178.8603 272 L 4.3234 7.8828 118.0709 56.7123 42.0513 178.2824 273 S 4.3941 8.2421 114.3487 56.9338 61.0473 172.7736 274 T 4.5902 7.3277 117.0218 58.7800 71.7334 176.3531 275 V 3.7691 8.4504 115.0702 64.6225 31.2536 178.2603 276 A 4.1439 7.9768 119.8673 55.3034 18.1112 178.8525 277 N 4.5283 7.7172 111.9376 54.9980 39.1110 176.8323 278 Q 4.1600 7.8131 118.8211 56.1997 28.9150 175.1606 279 D 4.6045 7.3910 120.7042 54.4041 42.5649 174.8822 280 V 4.6562 8.2759 124.5933 61.2955 33.5042 174.3856 281 I 4.3588 8.8340 128.6648 59.6295 39.7113 174.2789 282 R 4.4244 8.5463 129.7643 57.2112 30.9191 172.7326 283 L 4.3902 9.0432 123.3332 54.5958 43.7539 179.0634 284 A 3.3594 5.8000 124.6339 51.3973 19.4938 178.1877 285 P 4.3305 0.0000 0.0000 62.7254 32.1026 175.8549 286 W 4.7608 8.1796 128.8964 55.7262 33.6097 172.5002 287 P 3.0355 0.0000 0.0000 61.8609 31.4822 176.5423 288 R 4.0817 7.8152 115.6394 56.3309 29.4671 175.6803 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 0 G 8.35 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 E 8.12 4.13 0.00 2.03 1.93 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 2.30 2.36 0.00 3 R 8.49 3.96 0.00 1.83 2.14 0.00 3.35 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 4 A 8.01 4.01 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 5 A 7.97 3.99 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 6 F 8.64 4.14 0.00 3.10 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 7 G 8.32 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.12 4.06 0.00 1.99 1.89 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.67 7.81 9 L 7.62 3.87 0.00 1.71 1.58 0.98 0.87 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 10 V 7.40 3.52 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 1.08 0.00 0.00 0.61 0.00 0.00 11 Q 8.09 4.09 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 12 A 7.77 4.04 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 13 L 8.19 4.09 0.00 1.81 1.66 0.85 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.27 3.96 0.00 1.98 2.25 0.00 3.33 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.01 0.00 15 R 7.93 4.22 0.00 1.98 1.99 0.00 3.24 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.91 0.00 16 E 7.78 4.17 0.00 2.13 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 2.44 2.63 0.00 17 H 7.30 4.62 0.00 1.78 1.31 0.00 5.56 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 18 R 8.08 5.31 0.00 1.63 1.81 0.00 3.16 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 19 D 9.27 4.94 0.00 2.87 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 20 E 9.20 4.04 0.00 2.01 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 2.24 1.91 0.00 21 K 8.28 4.37 0.00 1.77 1.71 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.00 7.81 22 G 8.52 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.49 4.48 0.00 2.10 1.91 0.00 3.16 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 24 V 8.47 4.22 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 0.87 0.00 0.00 0.95 0.00 0.00 25 W 8.72 4.58 0.00 3.40 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.52 4.50 4.40 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 1.25 0.00 0.00 27 Q 8.57 4.06 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.94 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 28 E 8.12 3.93 0.00 2.02 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 2.39 2.42 0.00 29 V 7.48 3.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.78 0.00 0.00 30 L 7.96 3.77 0.00 1.96 1.83 1.09 0.89 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 31 A 8.35 3.96 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 32 E 8.16 3.79 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 33 R 7.77 3.82 0.00 1.63 1.86 0.00 3.14 0.00 0.00 3.02 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.63 0.00 34 T 7.92 4.23 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 1.30 0.00 0.00 35 Q 7.56 3.55 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 36 L 7.55 4.81 0.00 1.64 1.58 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.43 0.00 2.18 1.97 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 38 K 8.78 3.87 0.00 1.81 1.82 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.51 7.81 39 R 8.04 3.90 0.00 1.97 1.93 0.00 3.43 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 1.71 1.81 0.00 40 T 7.84 3.90 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 1.24 0.00 0.00 41 I 7.72 3.75 2.03 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 1.72 0.90 0.96 0.00 0.00 42 E 8.53 3.94 0.00 2.19 2.16 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 2.33 2.38 0.00 43 R 8.13 4.09 0.00 2.07 1.99 0.00 3.21 0.00 0.00 3.28 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 44 I 8.01 3.78 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 1.07 0.00 0.00 45 E 8.51 4.24 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 46 N 8.23 4.67 0.00 2.74 2.89 0.00 0.00 7.03 7.81 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 47 G 7.69 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 48 S 8.38 4.64 0.00 4.01 4.08 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 49 L 7.68 4.85 0.00 1.66 1.64 0.95 0.85 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 50 A 8.88 4.09 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 51 H 8.04 4.81 0.00 3.02 3.18 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.97 4.36 0.00 1.43 1.47 0.53 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.35 4.23 0.00 2.65 2.54 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 54 A 8.63 3.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.27 4.26 0.00 2.83 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 56 I 7.75 3.76 2.05 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 1.68 0.47 1.01 0.00 0.00 57 L 7.99 4.33 0.00 1.92 2.09 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.17 4.29 0.00 1.91 1.79 0.91 0.66 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 59 R 8.26 4.00 0.00 2.13 2.04 0.00 3.17 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 60 L 8.44 4.05 0.00 2.25 1.95 1.27 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.47 3.59 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 62 D 8.42 4.30 0.00 2.93 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 63 A 8.06 4.14 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 64 L 8.05 4.05 0.00 1.49 1.58 0.77 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 65 E 7.77 3.75 0.00 1.93 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 0.00 2.25 2.46 0.00 66 L 7.30 4.15 0.00 1.36 1.37 0.12 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.67 4.14 4.16 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 1.09 0.00 0.00 68 I 8.26 3.76 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.90 0.93 0.00 0.00 69 G 8.01 3.64 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 0.00 0.00 0.00 70 E 7.98 3.94 0.00 2.16 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 2.28 2.21 0.00 71 R 8.13 3.43 0.00 1.94 1.77 0.00 3.13 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.68 0.00 72 R 7.77 4.03 0.00 1.97 2.09 0.00 3.08 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 1.71 0.00 73 E 8.01 4.13 0.00 2.15 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 2.55 2.70 0.00 74 F 8.64 4.29 0.00 3.01 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 75 F 8.48 4.50 0.00 3.19 2.98 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 76 F 8.52 4.26 0.00 3.25 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 77 A 8.15 3.91 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 78 A 7.22 3.17 0.53 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 79 T 7.74 4.30 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 80 G 7.21 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 0.00 0.00 0.00 81 I 8.18 3.85 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.84 0.90 0.00 0.00 82 I 8.03 4.20 1.83 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 1.35 0.40 0.89 0.00 0.00 83 E 8.62 4.20 0.00 2.02 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 2.32 2.24 0.00 84 Q 8.65 4.14 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.28 1.92 0.00 85 K 7.71 4.35 0.00 1.83 1.81 0.00 1.52 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.42 7.81 86 S 8.40 4.24 0.00 3.87 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 87 A 8.40 3.91 0.99 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 0.00 0.00 88 T 7.81 4.44 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 89 Y 8.03 4.83 0.00 3.03 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 9.07 4.06 0.00 1.70 1.82 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.45 7.81 91 R 7.58 4.73 0.00 1.76 1.79 0.00 2.94 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 92 S 8.57 4.46 0.00 4.10 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 93 P 0.00 4.42 0.00 2.06 2.23 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 94 E 8.20 4.10 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 95 E 8.15 4.11 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 96 S 8.39 4.14 0.00 4.15 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 97 L 8.04 3.84 0.00 1.67 1.92 0.71 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.30 3.96 0.00 2.41 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 99 Y 7.89 4.07 0.00 3.09 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 0.00 100 L 7.67 4.03 0.00 1.75 1.65 0.82 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 101 I 7.98 3.88 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.66 0.90 0.00 0.00 102 D 8.14 4.51 0.00 2.67 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 *104 I 7.68 4.31 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.55 0.95 0.00 0.00 105 R 7.96 4.38 0.00 1.91 2.05 0.00 3.07 0.00 0.00 3.06 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 106 N 7.17 4.56 0.00 2.86 2.73 0.00 0.00 7.00 7.88 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 *108 N 7.64 4.67 0.00 2.81 2.93 0.00 0.00 6.18 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.23 4.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.86 0.00 0.00 110 P 0.00 4.47 0.00 1.64 1.68 0.00 2.46 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 0.49 1.10 0.00 111 A 9.13 5.33 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 F 8.62 5.24 0.00 3.17 2.99 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 0.00 113 V 9.22 4.83 2.03 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 0.79 0.00 0.00 0.87 0.00 0.00 114 T 9.14 5.84 4.41 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 1.43 0.00 0.00 115 D 8.24 5.01 0.00 3.06 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 0.00 116 Q 8.82 4.03 0.00 1.94 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.95 0.00 0.00 0.00 0.00 0.00 2.11 1.16 0.00 117 Y 8.24 4.86 0.00 3.48 3.37 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 0.00 118 V 8.10 3.64 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 1.19 0.00 0.00 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0.00 1.97 1.80 0.00 3.32 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 164 V 6.94 3.49 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 0.95 0.00 0.00 0.87 0.00 0.00 165 V 7.19 3.12 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.77 0.00 0.00 166 G 8.15 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 8.45 4.16 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 1.24 0.00 0.00 *169 W 7.68 4.97 0.00 3.42 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 0.00 170 D 8.33 4.26 0.00 2.87 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 0.00 171 E 8.10 3.93 0.00 2.16 2.17 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 2.52 2.44 0.00 172 V 7.57 2.93 1.98 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 190 D 8.12 4.71 0.00 3.32 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 0.00 191 G 8.97 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 0.00 192 Y 8.02 3.99 0.00 2.99 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 0.00 193 F 8.17 3.66 0.00 3.56 3.36 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 0.00 194 V 7.89 3.50 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 0.90 0.00 0.00 1.06 0.00 0.00 195 E 7.87 3.70 0.00 2.01 1.83 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 2.23 2.16 0.00 196 L 7.35 3.48 0.00 0.83 1.10 0.83 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 197 L 7.19 3.41 0.00 0.83 1.39 0.24 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 198 D 7.35 4.19 0.00 2.52 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 0.00 199 N 7.34 4.15 0.00 2.48 2.08 0.00 0.00 7.09 8.46 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 0.00 200 L 7.21 3.76 0.00 0.70 0.13 0.31 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 *202 Q 8.10 3.99 0.00 1.68 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.44 6.94 0.00 0.00 0.00 0.00 0.00 2.20 2.10 0.00 203 Y 7.64 4.63 0.00 3.24 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 0.00 204 R 8.96 4.01 0.00 1.97 2.08 0.00 3.26 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.82 0.00 205 E 8.51 4.45 0.00 2.52 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 2.63 2.62 0.00 206 F 8.53 3.15 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 0.00 207 K 8.33 3.94 0.00 1.98 2.04 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.48 7.81 208 R 8.09 3.88 0.00 2.18 2.17 0.00 3.04 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 209 F 8.23 4.03 0.00 2.97 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 W 7.96 3.85 0.00 2.90 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 0.00 211 E 8.30 4.17 0.00 2.03 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 2.50 2.68 0.00 212 R 7.57 4.16 0.00 1.92 1.83 0.00 2.69 0.00 0.00 2.78 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 213 A 7.56 3.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 H 8.03 4.19 0.00 3.27 3.41 0.00 5.53 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 L 7.38 4.07 0.00 1.65 1.66 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 216 E 7.35 4.08 0.00 1.95 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 2.43 2.39 0.00 217 T 8.47 4.30 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 0.00 218 E 7.95 4.63 0.00 1.97 1.90 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 2.22 2.26 0.00 219 D 8.63 5.03 0.00 2.61 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 T 9.62 4.67 4.46 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 1.31 0.00 0.00 221 S 8.33 4.05 0.00 4.02 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 A 7.95 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 0.00 223 E 7.96 4.86 0.00 2.16 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 2.25 2.27 0.00 224 N 8.54 4.78 0.00 2.67 2.86 0.00 0.00 6.36 8.13 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 0.00 225 F 8.70 4.85 0.00 2.74 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 0.00 226 W 8.03 5.05 0.00 3.28 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 0.00 227 Y 9.50 4.59 0.00 2.32 2.98 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 0.00 228 Q 8.88 5.09 0.00 1.70 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.05 0.00 229 Y 8.51 4.91 0.00 2.99 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 0.00 230 T 8.57 4.65 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 1.25 0.00 0.00 231 H 9.21 4.60 0.00 3.16 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.68 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 4.37 0.00 2.11 2.09 0.00 3.35 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.96 0.00 233 V 7.77 4.08 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 0.61 0.00 0.00 0.76 0.00 0.00 234 Y 7.81 4.57 0.00 2.94 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 G 8.01 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 0.00 236 L 8.57 4.38 0.00 1.61 1.61 0.98 0.84 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 0.00 237 L 8.53 4.95 0.00 1.29 1.65 1.24 0.40 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 0.00 238 S 9.15 5.14 0.00 4.01 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 0.00 239 Y 9.26 5.47 0.00 3.38 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 0.00 240 V 8.95 5.19 1.76 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 0.75 0.00 0.00 0.95 0.00 0.00 241 S 9.43 4.88 0.00 3.53 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 0.00 242 S 8.68 5.48 0.00 3.67 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 R 8.50 4.62 0.00 1.64 1.71 0.00 3.13 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.00 244 S 8.51 4.82 0.00 3.74 3.70 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 0.00 245 Q 8.63 5.17 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 246 I 8.79 4.80 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.93 0.00 0.00 247 P 0.00 5.07 0.00 2.39 2.20 0.00 3.77 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 2.17 2.07 0.00 248 T 7.75 4.00 4.21 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 1.27 0.00 0.00 249 S 7.61 4.24 0.00 4.04 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 *251 G 7.89 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 0.00 252 L 8.27 4.69 0.00 1.65 1.72 0.93 0.57 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 0.00 253 L 8.77 4.75 0.00 1.39 1.29 0.26 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 254 S 8.65 5.51 0.00 3.70 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *256 H 8.62 4.81 0.00 1.46 2.60 0.00 5.57 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 T 8.44 5.05 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 258 Y 8.45 5.06 0.00 2.52 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 0.00 259 I 8.85 4.53 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.64 0.90 0.00 0.00 260 P 0.00 4.66 0.00 1.97 1.63 0.00 3.80 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 261 L 8.94 5.00 0.00 1.62 1.60 -0.15 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 262 S 7.90 4.69 0.00 3.97 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 0.00 263 P 0.00 4.16 0.00 2.16 2.13 0.00 3.60 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 2.11 2.15 0.00 264 A 7.88 3.93 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 0.00 265 T 7.66 3.48 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 0.52 0.00 0.00 266 T 7.87 3.71 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 1.18 0.00 0.00 267 D 8.17 4.29 0.00 2.76 2.67 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 0.00 268 L 7.81 3.83 0.00 1.56 1.56 0.41 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 269 F 8.05 4.34 0.00 2.90 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 0.00 270 A 8.05 3.99 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 0.00 271 K 7.96 4.03 0.00 1.80 2.09 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.48 7.81 272 L 7.88 4.32 0.00 1.78 1.70 0.96 0.79 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 0.00 273 S 8.24 4.39 0.00 4.07 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 0.00 274 T 7.33 4.59 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 0.00 275 V 8.45 3.77 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 0.77 0.00 0.00 0.93 0.00 0.00 276 A 7.98 4.14 1.32 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 0.00 0.00 0.00 277 N 7.72 4.53 0.00 2.83 2.87 0.00 0.00 7.12 8.88 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 0.00 278 Q 7.81 4.16 0.00 2.30 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.98 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 279 D 7.39 4.60 0.00 2.82 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 0.00 280 V 8.28 4.66 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 0.88 0.00 0.00 0.97 0.00 0.00 281 I 8.83 4.36 1.88 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 1.13 1.26 0.95 0.00 0.00 282 R 8.55 4.42 0.00 1.86 1.79 0.00 3.23 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 283 L 9.04 4.39 0.00 1.44 1.01 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 284 A 5.80 3.36 1.16 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 0.00 0.00 285 P 0.00 4.33 0.00 2.17 2.05 0.00 3.76 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 286 W 8.18 4.76 0.00 3.21 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 0.00 287 P 0.00 3.04 0.00 1.60 0.98 0.00 3.46 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.98 0.00 288 R 7.82 4.08 0.00 1.72 1.76 0.00 3.01 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 * Residues marked with a * may have inaccurate shift predictions.