NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1304 D 4.5980 8.3493 120.1863 54.2930 42.2681 173.9510 1305 E 4.3864 9.6423 115.2881 55.4690 30.9537 175.0177 1306 Q 4.1886 9.1421 120.4401 57.1419 30.5655 177.0660 1307 Q 4.2749 7.7579 115.6057 57.7221 29.8249 177.7278 1308 S 4.0692 7.9720 112.4825 60.9806 62.5775 175.1608 1309 Q 4.1147 7.9581 116.3192 56.5192 28.9319 176.0688 1310 A 4.3344 7.4545 120.5761 53.1010 19.5847 178.0262 1311 V 4.2041 7.0285 108.4274 61.4194 32.1491 175.7603 1312 A 4.7119 7.5842 121.0527 49.2537 21.4078 175.3130 1313 P 4.2992 0.0000 0.0000 63.0336 32.0649 175.9253 1314 V 4.3883 8.3549 123.8195 61.2616 34.0084 174.1118 1315 Y 4.8305 9.2328 126.7916 57.4251 39.5902 174.9776 1316 V 4.8224 9.1010 122.6677 59.9902 34.7670 174.7826 1317 G 4.2555 9.8669 110.2784 43.7193 0.0000 171.6082 1318 G 4.0380 5.3800 107.8426 43.8867 0.0000 171.7682 1319 F 4.3912 7.7440 118.4455 56.5835 39.7646 177.1433 1320 L 4.2482 8.8797 124.4973 55.9759 42.4547 176.9033 1321 A 4.4458 7.4167 118.6107 51.2627 22.0180 174.9725 1322 R 4.6965 8.0934 120.3598 54.2841 31.8829 177.1440 1323 Y 4.4765 7.8362 121.7208 60.6415 37.9873 177.1009 1324 D 4.6087 8.0247 117.1946 54.0882 40.2956 176.0981 1325 Q 4.3708 7.6990 119.8780 54.6181 29.7855 175.6900 1326 S 4.4803 8.5287 117.8356 56.1897 62.6935 171.8196 1327 P 4.1876 0.0000 0.0000 63.0777 31.4890 176.5388 1328 D 4.5379 8.6301 120.5131 54.4447 40.1711 176.0194 1329 E 4.5099 7.7551 119.6012 55.0252 32.8772 176.0933 1330 A 3.9633 8.7607 128.0310 55.2563 18.9482 179.5492 1331 R 3.9960 7.9947 110.9584 59.2538 29.6146 177.8906 1332 L 4.1716 8.1575 117.3278 55.9841 41.7403 177.5417 1333 L 4.1339 7.3013 118.7147 55.3615 42.1282 177.1286 1334 L 4.4517 7.6723 117.0396 52.9642 43.6388 172.6838 1335 P 4.4705 0.0000 0.0000 61.4473 33.7888 176.3139 1336 R 3.1670 7.9197 119.6614 59.3035 29.5560 178.5742 1337 D 4.2354 7.6864 118.3924 56.3876 39.4991 178.4016 1338 V 3.1646 7.4506 119.5139 65.3437 31.4952 177.5642 1339 V 3.6931 7.4612 117.6704 66.4518 31.3432 177.6819 1340 E 4.1389 8.2729 117.8899 59.8555 29.0646 179.3090 1341 H 4.1240 7.8626 115.0358 58.6919 29.0835 177.2955 1342 W 4.6916 8.2024 120.7059 60.1233 28.7097 178.2294 1343 L 4.3368 8.7173 117.6131 58.6808 41.2957 178.7008 1344 H 4.3315 8.3331 116.1545 58.0598 30.7333 175.4257 1345 A 4.6280 8.0166 123.1841 51.6376 18.1144 175.9057 1346 Q 4.6830 8.1155 121.5092 54.5456 31.3419 177.1507 *1355 V 3.9545 8.2416 110.3421 61.0963 33.4097 175.1997 1356 A 4.2291 7.8600 123.9887 51.3289 19.0055 177.3782 1357 L 4.2694 8.5882 123.7739 54.3324 43.0172 175.2605 1358 P 4.6243 0.0000 0.0000 62.8153 33.1444 174.8185 1359 L 5.5526 9.0877 124.3316 53.0464 44.2256 174.5555 1360 N 5.6486 8.2800 125.3524 50.3468 41.3665 172.1553 1361 I 4.1669 8.0554 119.2308 59.8618 39.2512 175.8994 1362 N 3.8072 9.5679 128.8822 55.6533 37.6119 173.3974 1363 H 4.1150 7.9226 107.8343 56.6627 27.2224 174.6009 1364 D 4.6486 7.7997 120.1839 52.6275 40.8188 176.9467 1365 D 4.3248 8.6781 127.4371 55.6545 39.6429 177.1259 1366 T 4.0910 8.6599 109.8673 61.9769 70.1623 174.8041 1367 A 4.2753 7.6845 127.4888 51.1306 18.7526 176.9329 1368 V 4.2956 7.4068 121.2486 62.6698 32.8750 175.5450 1369 V 4.1065 8.4338 119.7876 61.4610 33.9488 175.5223 1370 G 4.7274 7.5602 107.4496 47.1903 0.0000 171.9480 1371 H 5.4654 8.1354 116.7771 53.6969 32.7290 173.1981 1372 V 4.0515 8.8428 120.7081 63.0968 31.2630 175.7273 1373 A 4.7243 9.1106 129.4457 53.0111 20.1294 176.5681 1374 A 4.7140 7.6490 114.3204 51.8266 22.4181 175.2257 1375 M 5.2014 8.8630 118.3959 54.2195 36.4781 174.8587 1376 Q 4.4615 8.7448 120.5438 55.4683 33.4493 173.0955 1377 S 4.6124 8.9329 122.0312 57.8904 63.1138 173.1673 1378 V 4.6113 8.5765 120.3957 58.8514 35.0501 176.4508 1379 R 3.9759 8.9056 120.4919 60.0861 29.7587 176.8692 1380 D 4.5124 8.7038 114.8799 54.5500 41.5301 176.5841 1381 G 3.3244 6.8763 106.1994 43.7638 0.0000 171.3383 1382 L 4.6786 7.5550 122.6658 54.4721 42.7838 175.3055 1383 F 4.7257 8.7901 129.8714 56.4554 41.8868 174.1532 1384 C 5.2855 7.7154 118.9458 56.4181 33.9144 172.2644 1385 L 5.0904 9.0831 121.2200 53.3616 44.9479 175.4440 1386 G 4.4817 9.7023 112.9054 44.5070 0.0000 170.6166 1387 C 4.8480 8.9823 120.1846 57.1473 34.6321 172.8167 1388 V 4.3932 8.6077 127.5405 62.4686 31.9077 176.0040 1389 T 4.6407 9.1442 116.6456 60.8842 70.6548 174.2397 1390 S 4.1600 8.1265 118.3252 57.9470 63.0599 172.3662 1391 P 4.2005 0.0000 0.0000 65.7047 31.0900 178.2381 1392 R 3.8375 8.7529 117.7253 59.5571 29.9907 177.9994 1393 F 3.4860 7.9551 119.9038 61.3087 39.2825 177.0588 1394 L 3.7469 8.2479 118.7884 57.6812 41.3392 179.2956 1395 E 3.7902 8.4399 119.7070 58.9980 29.4546 178.9846 1396 I 3.4682 7.5558 120.0629 64.3963 37.2368 178.5186 1397 V 2.8894 7.5683 119.2368 65.5872 30.9386 178.0217 1398 R 3.5743 7.7987 118.4977 59.3046 29.7677 178.3039 1399 R 3.8006 7.3948 116.3153 59.4542 30.3671 178.5336 1400 A 3.8958 7.6884 120.3384 55.0368 18.0849 179.6154 1401 S 3.8907 7.0059 111.5121 61.8059 62.7974 176.4595 1402 E 4.0335 7.6135 120.9528 57.8184 29.5946 177.5255 1403 K 4.5591 7.9779 118.9641 55.9888 32.8491 177.0889 1404 S 4.5985 7.6759 112.3726 55.8136 65.5284 172.4915 1405 E 3.9579 8.8477 129.1486 59.3606 29.1165 178.7738 1406 L 3.9062 7.9042 118.7391 58.3665 42.4216 178.8050 1407 V 3.7585 7.6759 117.4176 66.2348 31.2858 178.1173 1408 S 4.4074 8.3920 113.8854 61.3979 62.7039 176.0986 1409 R 4.2390 7.9615 118.4219 55.5844 30.1886 177.5659 1410 G 3.8994 8.1777 109.4966 44.5506 0.0000 170.4994 1411 P 4.6612 0.0000 0.0000 61.7433 33.2652 174.5439 1412 V 4.0073 8.5608 117.2681 64.4019 35.1686 178.3793 1413 S 3.2012 7.7332 111.7501 57.6776 63.7632 171.8577 1414 P 4.7789 0.0000 0.0000 62.7428 32.3273 176.0314 1415 L 3.9947 7.3050 118.6511 55.1374 41.9957 176.5737 1416 Q 4.3369 8.4597 120.7951 54.2336 29.6740 174.0336 1417 P 4.5419 0.0000 0.0000 63.6365 31.7504 176.1363 1418 D 4.4323 9.6810 119.7448 51.3891 41.9059 175.5360 1419 K 3.7106 8.3289 123.4390 59.4329 32.2231 177.9625 1420 V 3.4233 7.6363 117.1417 66.2945 31.4504 178.2765 1421 V 3.4364 7.6626 117.1945 66.1187 31.0771 177.8147 1422 E 4.0152 8.4803 118.6051 59.2812 29.2679 179.1942 1423 F 4.0251 8.6575 121.1399 61.2643 39.3995 177.2280 1424 L 3.7610 7.7216 118.5537 57.5233 40.9809 179.6931 1425 S 4.5287 7.4330 114.2990 61.6029 62.9328 176.7583 1426 G 3.5706 7.6686 106.6609 47.8452 0.0000 175.6795 1427 S 3.9002 7.7306 118.4370 59.7817 63.4470 173.8566 1428 Y 4.9982 7.2436 120.5062 56.2912 37.7906 175.0977 1429 A 4.5635 8.3345 123.7513 52.3419 20.5711 176.6180 1430 G 4.5145 9.0588 103.0097 44.1574 0.0000 172.2604 1431 L 5.4167 8.4677 118.9657 52.9202 45.8521 176.5267 1432 S 4.6327 8.7458 116.8182 56.7666 65.2221 172.9420 1433 L 4.5451 8.7109 130.0146 55.2006 43.1263 176.3800 1434 S 4.7445 9.4327 121.2330 56.5925 63.7213 172.6281 1435 S 5.1527 8.3570 120.2045 55.7025 66.6126 173.6286 1436 R 3.9714 8.3149 121.7195 56.3111 29.9668 177.0167 1437 R 4.0017 8.7951 120.9447 58.4655 29.4929 176.7377 *1453 T 4.1277 7.5350 108.0814 61.1377 70.0368 173.2301 1454 P 3.5023 0.0000 0.0000 65.4197 31.7082 175.1936 1455 F 4.8059 7.3535 117.3416 55.9924 38.8599 176.1014 1456 K 4.2827 9.0526 124.4870 58.3669 31.9160 177.8101 1457 H 4.8668 7.5936 112.3444 54.9554 32.6395 171.2113 1458 V 4.7605 8.6368 117.2687 61.0752 34.2442 174.1116 1459 A 5.2919 8.7631 129.0182 50.1345 22.1718 175.2212 1460 L 4.8768 8.5877 120.8786 54.3834 43.8703 175.6346 1461 C 5.0145 8.7453 115.7555 57.5858 32.9196 175.1467 1462 S 4.2877 8.9562 113.5173 60.7829 62.8150 175.0788 1463 V 4.3569 7.4008 117.3750 61.5256 33.1525 173.0191 1464 G 4.1203 8.3766 115.0112 44.0925 0.0000 174.7188 1465 R 4.1571 8.5102 118.2013 57.7623 30.4618 177.2842 1466 R 4.6988 7.0473 113.7349 54.1507 32.1520 176.3486 1467 R 4.3844 8.3808 120.1525 57.3091 30.9169 176.8090 1468 G 3.9188 10.5313 109.0457 46.3608 0.0000 174.0741 1469 T 5.5207 7.4399 108.5933 60.2718 69.4007 174.1634 1470 L 4.5744 8.2495 123.6948 56.4611 43.7023 174.9522 1471 A 4.8634 9.1998 128.1946 50.3175 20.8835 176.1481 1472 V 4.3111 8.7017 123.5020 61.4749 33.5921 173.9925 1473 Y 5.3429 8.7124 125.6491 56.7854 39.7539 175.1931 1474 G 4.5850 9.3127 109.1087 45.8865 0.0000 174.6360 1475 R 4.2514 8.8747 120.3633 57.8700 30.7068 177.1937 1476 D 4.7345 7.9772 117.6697 51.6261 43.1721 174.8392 1477 P 3.7375 0.0000 0.0000 65.8293 30.9010 178.0238 1478 E 3.9893 8.3225 118.5376 59.1615 29.2343 178.9125 1479 W 4.1303 8.5250 126.9046 60.6482 30.9089 177.8865 1480 V 3.4983 8.1765 118.2257 66.3328 30.7949 177.9983 1481 T 3.9755 8.5496 112.8812 64.9065 66.8975 175.3610 1482 Q 4.0156 7.8408 120.2581 58.2953 29.1476 176.8520 1483 R 3.6224 7.7223 117.9122 57.6320 30.4067 176.2879 1484 F 4.5598 7.7450 117.8611 54.9197 38.9376 174.8246 1485 P 4.3054 0.0000 0.0000 65.5985 31.3433 177.6186 1486 D 4.5143 8.2846 118.0277 57.0244 40.9777 177.0601 1487 L 4.4119 7.5597 118.1319 54.6388 42.4225 176.7925 1488 T 4.6239 8.4446 111.4705 59.6271 72.5839 175.2063 1489 A 4.0166 8.5522 123.1356 55.4471 18.2003 180.0044 1490 A 3.8435 7.8745 118.4516 55.4052 18.7262 179.0108 1491 D 4.2491 7.9339 117.3497 57.8872 40.8936 179.5244 1492 R 3.8677 8.3051 118.3688 59.4804 30.1021 178.6335 1493 D 4.2614 8.4941 119.0926 57.4410 40.8335 179.4920 1494 G 3.5244 7.8146 107.1403 47.2084 0.0000 175.8282 1495 L 3.9503 7.5691 121.5292 57.4077 41.7466 179.4883 1496 R 2.0000 7.7436 118.6907 58.0794 29.4911 178.4255 1497 A 3.7586 7.1421 119.5683 55.0243 18.4031 179.4059 1498 Q 4.0764 7.4369 115.8685 58.7645 28.9620 178.6003 1499 W 4.6808 8.3161 116.6043 58.3982 29.6259 177.8556 1500 Q 4.5129 7.3936 120.2427 52.8634 25.5359 176.0213 *1511 G 3.8523 8.2963 113.6023 45.1873 0.0000 172.8023 1512 D 4.2837 8.7254 125.2883 52.9599 40.7135 172.9255 1513 P 4.5504 0.0000 0.0000 62.7480 31.5256 176.1106 1514 F 4.5974 8.1200 122.0035 57.6366 38.0802 175.0146 1515 R 4.4767 8.1171 128.1246 55.9043 30.3207 176.1582 1516 S 4.6044 6.7167 112.4050 56.3930 65.7852 170.8118 1517 D 5.0830 8.0604 118.8881 50.9879 42.3932 175.6062 1518 S 4.1568 8.8695 112.9982 62.2547 62.4802 175.7869 1519 Y 4.1880 7.8822 120.4259 60.6553 37.5389 179.0097 1520 G 3.7197 8.4047 105.9466 48.0216 0.0000 175.5878 1521 L 4.1960 8.2035 122.0839 57.2843 41.4301 179.3016 1522 L 4.1628 8.7253 120.2346 58.0331 42.3862 179.1977 1523 G 3.7590 8.3224 105.6760 47.9688 0.0000 175.2949 1524 N 4.7394 8.4483 121.5450 55.1806 38.7020 176.7552 1525 S 4.4746 8.0504 114.8367 61.2640 62.5119 176.2859 1526 V 3.7495 7.8365 121.6189 65.0132 31.2641 177.8651 1527 D 4.5184 7.7775 119.2821 57.3406 40.7778 178.9095 1528 A 4.1911 7.8752 121.1305 55.0525 18.1876 179.4179 1529 L 3.9772 7.8888 116.2604 56.8770 41.6019 177.6326 1530 Y 4.4258 7.3823 114.7916 57.4169 38.5827 175.6461 1531 I 3.9649 7.7643 122.7339 60.4818 36.7849 175.6140 1532 R 3.9753 8.4002 126.7233 57.7294 30.4834 176.0927 1533 E 3.8390 8.9857 122.8630 57.4459 26.4496 175.8934 1534 R 3.8067 7.3027 118.4882 60.2031 29.7734 177.9834 1535 L 3.9720 7.8436 117.2156 57.6157 41.8724 177.6494 1536 P 4.2708 0.0000 0.0000 65.8153 31.3597 178.5706 1537 K 3.9398 8.4251 117.3769 59.6370 31.8716 179.3796 1538 L 4.1966 8.1162 118.9640 57.8585 41.5796 179.5857 1539 R 3.9317 8.1498 118.0486 59.5504 30.0775 178.2896 1540 Y 4.0880 8.2519 119.1552 60.9442 38.7529 178.0749 1541 D 4.3180 8.2974 119.6134 57.1081 40.9434 178.4562 1542 K 3.8326 8.2934 120.4056 59.8131 31.9924 178.4834 1543 Q 3.8975 7.8533 118.1470 59.0647 28.9514 177.7760 1544 L 3.8667 7.4549 120.5643 57.6500 42.2400 178.5578 1545 V 4.2467 7.7343 109.5717 60.8518 32.0088 176.9224 1546 G 3.8242 7.9416 107.5423 46.0383 0.0000 175.5277 1547 V 3.3447 7.5855 118.5662 64.3400 32.3202 177.3539 1548 T 3.9439 7.8357 114.2396 65.7795 67.4106 175.8794 1549 E 3.9702 7.3932 119.0733 58.8725 29.6116 177.4794 1550 R 4.3803 7.0434 115.7283 54.6291 32.1271 174.7425 1551 E 4.6505 8.4492 117.9327 55.0043 31.6331 175.6168 1552 S 4.6537 8.2111 119.0058 57.8684 65.3893 173.5789 1553 Y 4.6664 8.7173 119.6454 58.1514 38.2641 176.0743 1554 V 3.8998 7.4878 120.4601 63.2551 31.9871 175.8783 1555 K 4.4680 8.4336 122.3685 56.2392 34.0457 176.2416 1556 A 4.1806 8.0241 126.1067 52.3737 18.2794 177.0816 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 1304 D 8.35 4.60 0.00 2.63 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 1305 E 9.64 4.39 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 2.17 2.33 0.00 1306 Q 9.14 4.19 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 1307 Q 7.76 4.27 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 1308 S 7.97 4.07 0.00 3.83 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 1309 Q 7.96 4.11 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 1310 A 7.45 4.33 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 1311 V 7.03 4.20 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 0.71 0.00 0.00 0.96 0.00 0.00 1312 A 7.58 4.71 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1313 P 0.00 4.30 0.00 1.92 1.88 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 1314 V 8.35 4.39 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 1.25 0.00 0.00 0.99 0.00 0.00 1315 Y 9.23 4.83 0.00 3.24 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 1316 V 9.10 4.82 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.29 0.00 0.00 1317 G 9.87 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 0.00 0.00 0.00 1318 G 5.38 4.04 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 1319 F 7.74 4.39 0.00 3.34 3.05 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 1320 L 8.88 4.25 0.00 1.55 1.71 0.79 0.85 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 1321 A 7.42 4.45 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1322 R 8.09 4.70 0.00 1.75 1.87 0.00 2.77 0.00 0.00 2.51 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.40 0.00 1323 Y 7.84 4.48 0.00 3.03 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 1324 D 8.02 4.61 0.00 2.79 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 1325 Q 7.70 4.37 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 1326 S 8.53 4.48 0.00 3.99 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 1327 P 0.00 4.19 0.00 2.08 2.10 0.00 3.69 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 1328 D 8.63 4.54 0.00 2.78 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 1329 E 7.76 4.51 0.00 2.00 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 2.29 2.28 0.00 1330 A 8.76 3.96 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 1331 R 7.99 4.00 0.00 1.96 2.10 0.00 3.07 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 1332 L 8.16 4.17 0.00 1.81 1.81 0.95 0.92 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 1333 L 7.30 4.13 0.00 1.81 1.62 0.93 0.83 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 1334 L 7.67 4.45 0.00 1.59 1.60 0.79 1.19 0.00 0.00 0.00 0.00 0.00 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S 8.39 4.41 0.00 4.04 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 1409 R 7.96 4.24 0.00 2.00 1.98 0.00 3.32 0.00 0.00 3.23 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 1410 G 8.18 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 1411 P 0.00 4.66 0.00 2.17 2.38 0.00 3.83 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 1412 V 8.56 4.01 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 0.98 0.00 0.00 0.91 0.00 0.00 1413 S 7.73 3.20 0.00 3.94 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1414 P 0.00 4.78 0.00 2.14 2.11 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.94 0.00 1415 L 7.30 3.99 0.00 1.57 1.42 0.39 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 1416 Q 8.46 4.34 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 1417 P 0.00 4.54 0.00 2.20 2.16 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 1418 D 9.68 4.43 0.00 2.30 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1419 K 8.33 3.71 0.00 1.74 1.75 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.48 7.81 1420 V 7.64 3.42 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 0.91 0.00 0.00 0.81 0.00 0.00 1421 V 7.66 3.44 1.82 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 0.74 0.00 0.00 0.91 0.00 0.00 1422 E 8.48 4.02 0.00 2.19 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 2.53 2.35 0.00 1423 F 8.66 4.03 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1424 L 7.72 3.76 0.00 0.82 0.62 0.85 1.11 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1456 K 9.05 4.28 0.00 1.81 1.82 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.49 7.81 1457 H 7.59 4.87 0.00 3.40 3.40 0.00 5.39 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1458 V 8.64 4.76 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 0.89 0.00 0.00 0.89 0.00 0.00 1459 A 8.76 5.29 1.09 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 0.00 0.00 1460 L 8.59 4.88 0.00 1.24 1.63 1.04 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 1461 C 8.75 5.01 0.00 3.05 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 1462 S 8.96 4.29 0.00 4.04 4.11 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 1463 V 7.40 4.36 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 0.76 0.00 0.00 0.97 0.00 0.00 1464 G 8.38 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1465 R 8.51 4.16 0.00 1.86 2.04 0.00 3.21 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 1466 R 7.05 4.70 0.00 1.80 1.87 0.00 3.38 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 1467 R 8.38 4.38 0.00 1.97 2.27 0.00 3.38 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 1468 G 10.53 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 1469 T 7.44 5.52 4.38 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 1.35 0.00 0.00 1470 L 8.25 4.57 0.00 1.89 1.74 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 1471 A 9.20 4.86 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1472 V 8.70 4.31 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 0.93 0.00 0.00 0.87 0.00 0.00 1473 Y 8.71 5.34 0.00 3.07 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 1474 G 9.31 4.59 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 0.00 0.00 0.00 1475 R 8.87 4.25 0.00 1.79 2.03 0.00 3.33 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 1476 D 7.98 4.73 0.00 2.77 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1477 P 0.00 3.74 0.00 0.49 0.59 0.00 3.23 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.73 0.00 1478 E 8.32 3.99 0.00 2.33 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 2.48 2.58 0.00 1479 W 8.52 4.13 0.00 3.31 3.53 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 1480 V 8.18 3.50 2.27 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 1.24 0.00 0.00 1.29 0.00 0.00 1481 T 8.55 3.98 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 1.48 0.00 0.00 1482 Q 7.84 4.02 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 1483 R 7.72 3.62 0.00 1.43 1.31 0.00 2.51 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.08 0.00 1484 F 7.75 4.56 0.00 3.05 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 1485 P 0.00 4.31 0.00 2.17 2.16 0.00 3.90 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 1486 D 8.28 4.51 0.00 2.96 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 1487 L 7.56 4.41 0.00 1.48 1.42 0.17 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 1488 T 8.44 4.62 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 1.21 0.00 0.00 1489 A 8.55 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1490 A 7.87 3.84 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 1491 D 7.93 4.25 0.00 2.95 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 1492 R 8.31 3.87 0.00 1.93 1.99 0.00 3.14 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 1493 D 8.49 4.26 0.00 2.85 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 1494 G 7.81 3.52 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 0.00 0.00 0.00 1495 L 7.57 3.95 0.00 1.90 2.00 0.80 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 1496 R 7.74 2.00 0.00 0.89 1.50 0.00 2.92 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.09 0.00 1497 A 7.14 3.76 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 1498 Q 7.44 4.08 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 1499 W 8.32 4.68 0.00 3.33 3.43 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 1500 Q 7.39 4.51 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.61 0.00 0.00 0.00 0.00 0.00 2.51 2.28 0.00 *1511 G 8.30 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1512 D 8.73 4.28 0.00 2.71 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 1513 P 0.00 4.55 0.00 2.24 2.14 0.00 3.86 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 2.18 1.97 0.00 1514 F 8.12 4.60 0.00 3.10 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1515 R 8.12 4.48 0.00 1.72 1.84 0.00 3.19 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 1516 S 6.72 4.60 0.00 3.45 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 1517 D 8.06 5.08 0.00 3.02 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 1518 S 8.87 4.16 0.00 3.84 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 1519 Y 7.88 4.19 0.00 3.30 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 1520 G 8.40 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 1521 L 8.20 4.20 0.00 2.04 2.01 1.32 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 1522 L 8.73 4.16 0.00 1.87 1.96 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 1523 G 8.32 3.76 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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 1.24 1.48 0.95 0.00 0.00 1532 R 8.40 3.98 0.00 1.80 1.86 0.00 3.32 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 1533 E 8.99 3.84 0.00 2.22 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 0.00 2.26 2.21 0.00 1534 R 7.30 3.81 0.00 2.00 1.88 0.00 3.11 0.00 0.00 3.15 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 1535 L 7.84 3.97 0.00 1.69 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1536 P 0.00 4.27 0.00 2.25 2.12 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.20 0.00 1537 K 8.43 3.94 0.00 2.01 1.92 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.64 7.81 1538 L 8.12 4.20 0.00 2.04 1.75 1.03 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 1539 R 8.15 3.93 0.00 2.05 2.03 0.00 3.17 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 1.83 1.95 0.00 1540 Y 8.25 4.09 0.00 3.07 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 1541 D 8.30 4.32 0.00 2.98 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 1542 K 8.29 3.83 0.00 1.81 2.00 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.43 7.81 1543 Q 7.85 3.90 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 1544 L 7.45 3.87 0.00 1.27 1.65 0.72 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 1545 V 7.73 4.25 2.48 0.00 0.00 0.00 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 1.19 0.00 0.00 1546 G 7.94 3.82 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 0.00 0.00 0.00 1547 V 7.59 3.34 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 0.61 0.00 0.00 0.43 0.00 0.00 1548 T 7.84 3.94 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1549 E 7.39 3.97 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 1550 R 7.04 4.38 0.00 1.69 1.73 0.00 3.14 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 1551 E 8.45 4.65 0.00 1.92 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 2.17 2.22 0.00 1552 S 8.21 4.65 0.00 3.97 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 1553 Y 8.72 4.67 0.00 3.21 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 1554 V 7.49 3.90 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 0.83 0.00 0.00 0.98 0.00 0.00 1555 K 8.43 4.47 0.00 1.76 1.81 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.27 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.33 7.81 1556 A 8.02 4.18 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 * Residues marked with a * may have inaccurate shift predictions.