NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1566 G 3.7486 8.3549 109.7411 45.3184 0.0000 172.9103 1567 N 4.5403 8.1677 121.7840 51.2977 39.9258 173.2327 1568 F 5.1758 8.8602 122.6359 55.3768 42.7927 174.5729 1569 C 4.8689 9.3312 124.1392 58.7680 31.9900 172.6200 1570 P 4.5513 0.0000 0.0000 64.5252 31.1474 176.6133 1571 L 4.6888 7.9193 117.8459 54.9305 42.1183 176.3634 1572 C 4.7037 7.6357 110.6594 56.8949 31.9830 174.3592 1573 D 4.9374 8.2779 118.8274 55.2169 38.8305 173.1558 1574 K 4.6995 7.5000 118.5507 54.8437 33.5219 175.8577 1575 C 3.7680 8.6873 123.8433 59.3842 32.1380 172.5939 1576 Y 5.5004 7.5533 122.8438 56.0733 38.0672 177.1483 1577 D 4.2282 7.7256 121.8027 57.6365 40.8993 176.9284 1578 D 4.7413 7.7540 115.4579 53.9058 41.3143 176.0840 1579 D 4.4230 7.9716 121.7458 54.1811 41.4064 176.3157 1580 D 4.8520 8.4357 123.2485 52.4239 40.7311 176.3109 1581 Y 4.0608 8.7073 120.1728 60.9497 38.5216 177.4364 1582 E 3.7134 7.5228 116.2007 58.3586 29.6009 176.9676 1583 S 4.0889 7.7421 113.5519 57.4568 61.7104 173.1761 1584 K 4.1214 8.1693 128.5258 56.9343 33.4596 176.0412 1585 M 5.4122 8.5573 123.1988 53.8471 36.7879 173.9119 1586 M 4.8770 8.9057 116.5539 53.6511 34.8353 174.0588 1587 Q 3.8355 7.7206 121.8008 54.4270 30.7565 174.4038 1588 C 4.3827 8.6900 127.6856 59.0782 32.1429 174.6411 1589 G 3.6842 8.7817 115.4765 47.3289 0.0000 174.4438 1590 K 4.2181 7.8937 118.6525 57.6427 33.0825 176.9939 1591 C 4.6228 7.6268 110.1161 57.0322 30.4748 174.4376 1592 D 4.4312 8.1244 118.6302 55.0626 39.0220 174.0439 1593 R 4.5105 7.3204 117.4580 55.9414 31.4935 175.5064 1594 W 4.9922 8.7705 120.8992 55.0605 31.6881 175.8717 1595 V 4.4666 8.4627 121.9151 61.0929 34.7140 174.8074 1596 H 4.6250 8.7403 124.5975 55.7971 29.5760 176.4078 1597 S 3.9970 8.7508 118.4480 61.4674 61.9582 176.8506 1598 K 3.9886 7.8996 119.4999 59.1663 31.8716 178.0123 1599 C 4.4242 7.6844 114.3447 59.3885 28.6173 172.8600 1600 E 4.7730 7.2148 121.0518 54.3219 31.5572 176.0353 1601 N 4.8272 8.3198 120.6923 51.6647 36.9396 173.9765 1602 L 4.6582 7.6191 119.0955 52.2267 46.3967 176.6514 1603 S 4.6175 8.5010 118.3603 57.3152 66.0647 175.0396 1604 D 4.3576 8.4892 121.2883 57.4958 40.4708 178.9305 1605 E 3.5906 8.0972 118.4504 59.7414 29.6287 179.2288 1606 M 4.0197 7.9386 118.5843 58.2995 31.8562 178.1025 1607 Y 3.8955 8.0403 119.7958 60.8745 38.9462 178.2912 1608 E 3.5191 7.7221 119.0353 58.9886 29.1747 179.4342 1609 I 3.6432 7.0300 120.0445 64.0454 36.6434 178.2278 1610 L 3.9455 7.7054 121.1257 58.3637 41.7573 179.3159 1611 S 3.9690 7.5376 113.7531 61.1379 62.6598 175.8626 1612 N 4.5842 7.8674 119.5160 55.5140 40.4081 175.2401 1613 L 4.7027 7.5461 120.1703 51.4104 42.9912 173.7378 1614 P 4.3710 0.0000 0.0000 65.0755 31.1529 178.1560 1615 E 4.0269 8.0367 115.1321 58.6486 29.7156 178.6180 1616 S 4.2901 7.8877 115.6169 60.6806 63.0792 175.6220 1617 V 4.0000 7.8600 119.8025 62.2876 32.9256 175.0860 1618 A 3.8291 8.1525 119.6814 52.7317 16.3924 176.5673 1619 Y 3.9038 7.5198 122.9179 57.6775 39.8952 175.0084 1620 T 4.4498 6.4295 114.9974 59.4529 71.8684 173.5600 1621 C 4.2216 7.9500 119.5100 56.9273 30.9654 174.5865 1622 V 3.7014 8.3395 119.0872 64.9416 30.6878 177.2885 1623 N 4.5327 8.1167 115.8478 54.9200 38.6631 175.1640 1624 C 4.6481 7.8470 113.7483 59.4557 29.2444 173.5687 1625 T 4.3862 7.6712 117.8024 62.1924 69.0736 174.3853 1626 E 4.0499 8.8647 125.3527 58.7712 30.2582 176.9771 1627 R 4.6342 7.5089 117.1278 53.6538 33.0861 174.9863 1628 H 4.9457 8.2508 116.0745 53.3636 32.0277 172.1118 1629 P 4.4588 0.0000 0.0000 61.6478 32.4862 175.9448 1630 A 4.0577 8.1113 122.4897 52.1138 19.1574 178.4158 1631 E 3.9033 8.7744 123.0569 59.1203 29.5894 179.6643 1632 W 4.6390 8.0201 117.6597 59.0193 28.1902 178.2068 1633 R 3.1282 6.5153 119.0861 58.8718 29.3599 178.5439 1634 L 4.0538 7.5503 118.1407 57.6258 41.6329 179.1619 1635 A 4.0143 8.1215 120.8433 55.0653 18.3379 179.5011 1636 L 3.9937 8.3006 119.0781 58.2786 42.1639 179.0177 1637 E 3.9831 8.2307 118.7117 59.2377 29.3378 179.2883 1638 K 3.9576 8.1206 119.7531 59.3815 32.3047 178.4158 1639 E 3.9198 8.4144 119.8006 59.1385 29.4407 178.5283 1640 L 4.0790 7.9405 120.2492 58.4159 42.2183 179.0006 1641 Q 3.9670 7.8983 117.4671 59.1230 28.6711 178.9753 1642 I 3.7377 7.9769 120.8690 64.3644 37.0899 178.7614 1643 S 3.9629 8.1518 116.0394 61.4608 62.6777 176.6647 1644 L 3.5650 8.0405 121.8231 57.5626 41.2456 179.5506 1645 K 3.9468 7.9761 119.5275 59.3910 32.2176 178.5691 1646 Q 3.9180 8.0123 119.9771 59.0542 29.0204 178.6158 1647 V 3.5623 7.5660 118.7500 65.9629 31.6120 177.7667 1648 L 4.1298 8.1609 120.1110 58.5746 41.9581 178.9721 1649 T 3.8810 8.2195 115.5187 66.6562 68.1585 176.4034 1650 A 4.1253 7.7495 121.1899 55.1174 18.7585 179.4660 1651 L 4.4619 8.0276 117.2707 58.1803 41.5945 179.7863 1652 L 4.1501 8.1149 117.5621 57.2906 41.6267 178.4084 1653 N 4.7556 8.1132 114.3856 52.8561 39.0418 174.6153 1654 S 4.5422 7.5632 117.1309 56.7910 63.4517 174.5888 1655 R 3.9297 8.7456 127.4282 59.8383 29.9271 179.0843 1656 T 3.8635 7.7745 114.8234 66.8987 68.4230 176.7850 1657 T 3.8682 7.7537 117.3235 66.6074 68.5350 176.7264 1658 S 4.0268 8.6036 115.3620 61.6500 62.2287 175.2950 1659 H 4.0098 8.1205 119.7403 59.5810 29.5678 176.3388 1660 L 4.2183 7.8356 120.2248 56.8571 42.3632 177.6213 1661 L 4.6181 8.2035 117.2350 54.4341 43.4850 178.6742 1662 R 3.6578 8.3259 119.5755 57.6799 29.8900 175.5758 1663 Y 5.1943 7.1159 114.5792 55.8504 42.1848 173.4328 1664 R 3.7385 9.3856 127.5278 57.4526 28.4380 178.1910 *1704 Q 3.9749 9.1304 116.2369 54.9309 30.0854 171.7753 1705 P 4.4095 0.0000 0.0000 62.7303 31.9172 176.4131 1706 L 4.5207 8.2835 120.3271 54.7991 43.2986 175.4585 1707 D 4.6307 7.3754 117.0619 50.7312 42.3150 176.0560 1708 L 3.9222 8.4259 119.3465 57.7483 41.3041 179.4845 1709 E 3.9167 8.2008 119.6813 59.1700 29.4994 179.1687 1710 G 3.6084 8.4884 106.0105 47.7063 0.0000 175.9227 1711 V 3.8040 7.6524 120.3158 65.5513 31.5635 178.0251 1712 K 4.0096 8.3728 119.6837 59.7177 31.9579 179.0060 1713 R 3.9860 8.0566 118.3124 59.1192 29.9801 179.0132 1714 K 3.8839 8.1660 119.4992 59.5255 32.1613 178.6634 1715 M 4.3151 8.7370 118.9166 59.0422 32.1172 177.9663 1716 D 4.6169 8.4927 117.8189 57.1419 41.0307 177.9607 1717 Q 4.3660 7.7511 116.3042 55.2193 28.9893 176.0138 1718 G 3.9190 8.4022 108.3532 46.8289 0.0000 174.7072 1719 N 4.4899 8.0735 116.9018 53.8599 39.0342 175.1204 1720 Y 4.6103 7.8066 117.1910 57.4448 38.5959 175.2090 1721 T 4.6076 8.6808 113.7347 61.3757 70.0253 174.6442 1722 S 4.6910 7.5862 116.5798 56.1461 67.2691 174.9385 1723 V 3.1746 8.9964 123.5770 65.8496 31.1748 178.2933 1724 L 4.1824 8.0444 119.9850 58.0914 41.9402 178.5779 1725 E 3.9961 8.2913 119.2683 59.2626 29.7792 178.5653 1726 F 3.6249 7.9417 120.6410 61.1403 39.4165 176.9461 1727 S 4.1297 8.5343 113.0032 61.6453 62.1864 175.7916 1728 D 4.3745 8.6354 121.8687 57.4525 40.5116 178.4533 1729 D 4.1697 7.9722 119.2941 57.5274 40.7629 179.1108 1730 I 3.3864 7.1535 119.6440 63.9169 36.9625 178.5466 1731 V 2.8561 7.7090 119.4898 65.6400 31.2114 178.1821 1732 K 3.7486 7.8471 118.3569 59.4387 31.8726 179.3820 1733 I 3.6112 7.2623 119.5187 64.2971 36.9086 178.6245 1734 I 3.6722 7.8142 120.9590 64.5053 36.9164 178.3349 1735 Q 4.0673 8.4589 120.6032 59.0825 28.8894 178.0902 1736 A 3.9635 8.1657 121.6891 54.9914 18.3205 179.5005 1737 A 3.9316 7.8526 118.7526 55.4443 18.2901 179.8390 1738 I 3.6762 7.8079 117.2446 64.7982 37.2800 178.2604 1739 N 4.5859 8.5203 116.5375 55.0295 38.1889 176.4253 1740 S 4.7580 7.8292 113.0599 57.8170 63.8463 174.5578 1741 D 4.7117 8.2725 121.9724 53.4875 39.4957 177.2884 1742 G 3.8062 7.7312 107.9083 45.0666 0.0000 174.3105 1743 G 4.0860 8.2052 108.6276 44.9706 0.0000 173.7087 1744 Q 4.0857 7.9463 120.7023 55.0714 30.8368 174.9619 1745 P 4.2573 0.0000 0.0000 65.9922 31.5596 178.9300 1746 E 4.0339 8.1544 116.6590 59.2629 29.3035 179.4424 1747 I 3.7693 7.5696 119.6315 64.2466 36.8965 178.3200 1748 K 3.9787 8.1166 119.3499 59.4197 31.7733 179.6182 1749 K 3.8384 8.1366 118.5538 59.4274 31.9708 179.3421 1750 A 4.0364 8.1392 121.0350 54.9915 18.3022 179.2688 1751 N 4.2894 8.3368 115.2538 56.9257 38.6446 177.7962 1752 S 4.1775 7.6813 115.9727 61.6854 62.8860 176.6387 1753 M 4.0857 7.8355 121.3090 58.3330 31.7015 179.0288 1754 V 3.7209 8.3194 118.8676 65.7833 31.7699 177.9506 1755 K 4.1606 8.0613 119.2308 59.8900 31.9846 178.9744 1756 S 4.1612 8.3293 115.4626 61.4296 62.6917 176.4291 1757 F 4.2951 8.5632 123.5115 61.2477 39.1459 176.9630 1758 F 4.2024 8.5650 120.2267 61.4782 39.2505 177.0923 1759 I 3.4363 7.8914 119.3733 64.4434 36.9535 178.6602 1760 R 3.8518 8.1653 119.0264 59.2625 29.9494 179.1923 1761 Q 3.7969 7.7412 117.8695 59.1501 28.6879 178.7038 1762 M 4.0702 7.7934 119.7183 58.3786 32.0345 178.7171 1763 E 4.1402 8.2580 118.8290 58.9390 29.3214 179.4356 1764 R 3.8759 7.5235 118.1853 59.4089 30.2904 178.3274 1765 V 3.6293 7.2082 116.1429 63.8616 33.0898 175.9853 1766 F 4.8499 8.0894 117.5946 54.6018 38.8171 173.6509 1767 P 4.4267 0.0000 0.0000 64.2304 31.8098 178.5337 1768 W 4.4621 7.7309 114.2110 57.2198 28.7773 175.6077 1769 F 4.3203 6.9729 122.5248 57.0842 40.0799 176.6852 1770 S 4.3185 7.3537 126.0433 57.0321 61.3502 175.0806 1771 V 3.7584 7.3254 123.3057 64.4908 31.9386 179.7571 1772 K 4.1197 8.0062 118.6904 58.7696 32.0040 177.5430 1773 K 4.4129 7.6630 116.2138 55.9519 32.1802 176.7547 1774 S 4.1235 8.0177 115.4119 58.7261 62.4750 175.4206 1775 R 3.9484 8.3201 122.7817 57.9493 29.4177 176.9472 1776 F 4.6564 7.3186 116.1872 57.1812 39.3581 175.9398 1777 W 4.8254 7.6435 121.5120 56.3752 29.7525 176.2949 1778 E 4.3901 9.4716 120.6456 56.6918 29.5384 175.9228 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 1566 G 8.35 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 1567 N 8.17 4.54 0.00 1.91 2.26 0.00 0.00 6.48 7.26 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 1568 F 8.86 5.18 0.00 2.88 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 1569 C 9.33 4.87 0.00 3.13 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 1570 P 0.00 4.55 0.00 2.29 2.25 0.00 3.93 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 2.08 2.07 0.00 1571 L 7.92 4.69 0.00 1.72 1.79 1.08 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 1572 C 7.64 4.70 0.00 3.09 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 1573 D 8.28 4.94 0.00 2.91 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 1574 K 7.50 4.70 0.00 1.79 1.81 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.65 1.56 7.81 1575 C 8.69 3.77 0.00 1.88 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 1576 Y 7.55 5.50 0.00 3.09 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 1577 D 7.73 4.23 0.00 2.49 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 1578 D 7.75 4.74 0.00 2.62 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 1579 D 7.97 4.42 0.00 3.03 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 1580 D 8.44 4.85 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1581 Y 8.71 4.06 0.00 2.91 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 1582 E 7.52 3.71 0.00 2.10 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 2.39 2.38 0.00 1583 S 7.74 4.09 0.00 3.79 3.79 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 1584 K 8.17 4.12 0.00 1.03 1.60 0.00 1.27 0.00 0.00 1.56 0.00 0.00 2.35 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.20 0.93 7.81 1585 M 8.56 5.41 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.38 0.00 1586 M 8.91 4.88 0.00 1.71 1.55 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.80 0.00 1587 Q 7.72 3.84 0.00 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.98 0.00 0.00 0.00 0.00 0.00 1.71 1.45 0.00 1588 C 8.69 4.38 0.00 2.91 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 1589 G 8.78 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1590 K 7.89 4.22 0.00 1.69 1.83 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.34 7.81 1591 C 7.63 4.62 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 1592 D 8.12 4.43 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1593 R 7.32 4.51 0.00 1.84 2.01 0.00 3.45 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 1594 W 8.77 4.99 0.00 2.12 2.69 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 0.00 0.00 0.00 0.00 1595 V 8.46 4.47 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.07 0.00 0.00 1596 H 8.74 4.62 0.00 3.24 3.11 0.00 5.87 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1597 S 8.75 4.00 0.00 3.34 3.48 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 0.00 0.00 0.00 0.00 1598 K 7.90 3.99 0.00 1.69 1.82 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.40 7.81 1599 C 7.68 4.42 0.00 3.14 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 1600 E 7.21 4.77 0.00 1.94 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 2.23 2.52 0.00 1601 N 8.32 4.83 0.00 2.87 2.83 0.00 0.00 6.76 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1602 L 7.62 4.66 0.00 1.66 1.58 0.92 1.16 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 1603 S 8.50 4.62 0.00 4.07 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 1604 D 8.49 4.36 0.00 2.75 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 1605 E 8.10 3.59 0.00 2.02 1.97 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 2.77 2.56 0.00 1606 M 7.94 4.02 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.71 0.00 1607 Y 8.04 3.90 0.00 2.94 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 1608 E 7.72 3.52 0.00 1.16 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 2.38 2.39 0.00 1609 I 7.03 3.64 1.93 0.00 0.00 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 1.78 1.03 1.00 0.00 0.00 1610 L 7.71 3.95 0.00 1.71 1.62 0.60 0.50 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 1611 S 7.54 3.97 0.00 3.43 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 1612 N 7.87 4.58 0.00 2.94 3.06 0.00 0.00 6.89 7.08 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 1613 L 7.55 4.70 0.00 1.77 1.47 0.97 0.86 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 1614 P 0.00 4.37 0.00 2.23 2.22 0.00 3.89 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.87 0.00 1615 E 8.04 4.03 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 2.27 2.34 0.00 1616 S 7.89 4.29 0.00 4.06 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1617 V 7.86 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1626 E 8.86 4.05 0.00 2.01 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 2.25 2.35 0.00 1627 R 7.51 4.63 0.00 1.71 1.79 0.00 3.11 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 1628 H 8.25 4.95 0.00 3.04 3.13 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1629 P 0.00 4.46 0.00 2.04 1.97 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 1630 A 8.11 4.06 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 1631 E 8.77 3.90 0.00 1.94 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 2.31 2.47 0.00 1632 W 8.02 4.64 0.00 3.75 3.44 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 1633 R 6.52 3.13 0.00 0.67 1.46 0.00 2.77 0.00 0.00 2.97 7.56 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0.00 0.00 0.00 0.00 2.59 2.56 0.00 1642 I 7.98 3.74 1.86 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 1.76 1.16 0.88 0.00 0.00 1643 S 8.15 3.96 0.00 4.12 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 1644 L 8.04 3.56 0.00 1.52 0.80 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 1645 K 7.98 3.95 0.00 1.89 1.99 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.46 7.81 1646 Q 8.01 3.92 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 1647 V 7.57 3.56 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 1.23 0.00 0.00 0.96 0.00 0.00 1648 L 8.16 4.13 0.00 2.13 1.77 0.98 0.82 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 1649 T 8.22 3.88 4.27 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 1.24 0.00 0.00 1650 A 7.75 4.13 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 1651 L 8.03 4.46 0.00 1.98 1.85 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 1652 L 8.11 4.15 0.00 1.65 1.76 0.94 1.30 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 1653 N 8.11 4.76 0.00 2.85 2.91 0.00 0.00 6.87 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1654 S 7.56 4.54 0.00 3.68 3.94 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 0.00 0.00 0.00 1655 R 8.75 3.93 0.00 1.88 1.97 0.00 3.19 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 1656 T 7.77 3.86 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 1.19 0.00 0.00 1657 T 7.75 3.87 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 1.33 0.00 0.00 1658 S 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0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1722 S 7.59 4.69 0.00 4.21 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 1723 V 9.00 3.17 1.65 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 -0.93 0.00 0.00 0.26 0.00 0.00 1724 L 8.04 4.18 0.00 2.24 1.79 1.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 1725 E 8.29 4.00 0.00 2.22 2.30 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 2.76 2.47 0.00 1726 F 7.94 3.62 0.00 2.47 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1727 S 8.53 4.13 0.00 3.91 4.14 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 1728 D 8.64 4.37 0.00 2.77 2.56 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 1729 D 7.97 4.17 0.00 2.77 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 1730 I 7.15 3.39 1.28 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.12 -0.23 0.00 0.00 1731 V 7.71 2.86 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 -0.38 0.00 0.00 0.56 0.00 0.00 1732 K 7.85 3.75 0.00 1.70 1.59 0.00 1.25 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 0.90 7.81 1733 I 7.26 3.61 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.88 0.79 0.00 0.00 1734 I 7.81 3.67 1.98 0.00 0.00 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 1.37 0.57 1.17 0.00 0.00 1735 Q 8.46 4.07 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 1736 A 8.17 3.96 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 1737 A 7.85 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1738 I 7.81 3.68 2.10 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.84 0.96 0.00 0.00 1739 N 8.52 4.59 0.00 2.86 2.91 0.00 0.00 6.86 7.96 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 1740 S 7.83 4.76 0.00 4.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1741 D 8.27 4.71 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1742 G 7.73 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 1743 G 8.21 4.09 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 0.00 1744 Q 7.95 4.09 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.06 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 1745 P 0.00 4.26 0.00 2.19 2.09 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 1746 E 8.15 4.03 0.00 1.97 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 2.39 2.34 0.00 1747 I 7.57 3.77 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 1.64 0.86 0.98 0.00 0.00 1748 K 8.12 3.98 0.00 1.94 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.63 7.81 1749 K 8.14 3.84 0.00 1.95 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.63 7.81 1750 A 8.14 4.04 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 1751 N 8.34 4.29 0.00 2.95 2.92 0.00 0.00 6.97 6.73 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 1752 S 7.68 4.18 0.00 3.83 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1753 M 7.84 4.09 0.00 1.99 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.83 0.00 1754 V 8.32 3.72 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 1.10 0.00 0.00 0.99 0.00 0.00 1755 K 8.06 4.16 0.00 1.93 1.90 0.00 1.26 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.96 7.81 1756 S 8.33 4.16 0.00 4.03 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 1757 F 8.56 4.30 0.00 3.24 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 1758 F 8.57 4.20 0.00 3.26 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1759 I 7.89 3.44 1.96 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.74 0.85 0.00 0.00 1760 R 8.17 3.85 0.00 1.90 1.90 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 1761 Q 7.74 3.80 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.86 2.01 0.00 1762 M 7.79 4.07 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.10 0.00 1763 E 8.26 4.14 0.00 1.94 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 2.27 2.42 0.00 1764 R 7.52 3.88 0.00 1.82 2.01 0.00 3.18 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 1765 V 7.21 3.63 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 -0.10 0.00 0.00 0.73 0.00 0.00 1766 F 8.09 4.85 0.00 2.76 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 0.00 0.00 0.00 1767 P 0.00 4.43 0.00 2.25 2.20 0.00 3.50 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.96 0.00 1768 W 7.73 4.46 0.00 3.70 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 1769 F 6.97 4.32 0.00 1.51 2.53 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 1770 S 7.35 4.32 0.00 3.59 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 1771 V 7.33 3.76 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 0.82 0.00 0.00 1.08 0.00 0.00 1772 K 8.01 4.12 0.00 1.75 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.44 7.81 1773 K 7.66 4.41 0.00 1.79 1.81 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.33 7.81 1774 S 8.02 4.12 0.00 3.80 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 1775 R 8.32 3.95 0.00 1.57 1.79 0.00 2.85 0.00 0.00 2.89 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 1776 F 7.32 4.66 0.00 2.83 2.94 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 0.00 0.00 0.00 1777 W 7.64 4.83 0.00 3.29 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 1778 E 9.47 4.39 0.00 2.01 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 2.31 2.33 0.00 * Residues marked with a * may have inaccurate shift predictions.