NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 4.4876 8.3393 109.7339 46.2744 0.0000 173.7433 0 S 4.5951 7.9133 110.3355 57.1847 64.0787 171.0129 1 E 4.2604 8.1176 119.8879 56.6585 31.2344 177.6672 2 Q 4.4863 8.5755 122.6840 56.9263 29.8272 176.0685 3 T 4.5950 9.3536 113.6502 62.6446 72.0705 172.9371 4 H 5.5546 8.0342 116.9977 54.4897 34.2346 172.0296 5 R 5.1038 8.8497 118.0528 54.9305 33.7630 174.0354 6 A 4.6232 9.1307 129.0587 52.0158 19.1691 177.6998 7 I 4.2947 8.6486 114.6698 60.4826 39.1475 175.5686 8 F 5.1842 7.6437 120.0950 55.3674 42.8020 174.4615 9 R 4.4003 8.8486 122.0985 56.4461 30.9126 175.4202 10 F 5.0105 9.4359 128.2132 56.6360 42.4692 173.4629 11 V 4.2624 8.0010 126.8399 60.2070 32.4423 173.6692 12 P 4.1387 0.0000 0.0000 63.2164 31.6343 176.4832 13 R 4.4903 9.3897 119.0817 55.8916 32.4411 175.7106 14 H 5.0218 8.0741 114.5986 53.5143 31.8590 174.5274 15 E 4.1113 8.8820 122.1835 58.7895 29.5714 177.5901 16 D 4.6585 8.0120 117.0202 53.7442 40.3251 175.9594 17 E 5.1312 7.9632 119.9153 56.2251 30.7967 175.5944 18 L 4.7596 8.9034 124.7993 53.2900 43.4762 175.8798 19 E 4.4045 8.9311 127.7465 56.3653 30.6167 175.7030 20 L 5.0747 9.1966 125.3811 53.0364 46.1843 175.2416 21 E 4.9935 9.3084 121.7807 53.9722 33.0260 175.9214 22 V 3.6635 8.3972 122.2228 65.0317 31.7860 175.7360 23 D 4.6853 9.1450 125.4507 53.9720 40.8700 173.7294 24 D 4.5968 7.9750 119.2758 54.4658 41.7586 173.8909 25 P 4.7845 0.0000 0.0000 62.6721 32.4488 175.5787 26 L 5.0821 9.3207 122.6277 52.8529 46.4923 175.4783 27 L 4.9609 8.8178 123.5829 53.3824 44.0533 175.2641 28 V 4.2789 9.1049 128.0139 62.4747 31.3112 175.6394 29 E 4.2989 9.0989 128.7345 58.4206 30.6020 177.2266 30 L 4.4472 7.5931 120.7407 53.7225 45.7457 175.5807 31 Q 4.4682 8.5136 125.7588 53.6088 28.2638 175.0557 32 A 4.2178 8.4524 125.4362 51.6635 19.2724 179.0325 33 E 3.9834 8.7154 119.8467 59.2210 29.6950 177.7347 34 D 4.9806 8.1928 116.7676 53.4997 39.6730 175.6343 35 Y 3.5108 8.0046 114.9029 59.5105 36.1070 168.8508 36 W 4.9083 8.3117 118.1431 55.1232 32.7984 174.2028 37 Y 5.1766 8.5145 121.2837 56.4894 40.1497 174.4336 38 E 5.1710 9.1400 122.7451 54.8103 32.1912 175.1785 39 A 5.2571 9.2772 125.7162 51.2659 23.6917 173.3690 40 Y 5.2032 8.9916 119.4472 56.3005 41.5441 175.4086 41 N 4.3931 8.8149 126.1821 53.8332 41.3341 175.7152 43 R 3.1432 8.3815 113.1104 58.7826 30.9958 177.1059 44 T 4.1248 7.7000 107.1453 61.3374 69.5464 175.9247 45 G 3.7536 8.4292 109.6023 44.6623 0.0000 173.2914 46 A 4.5495 7.4324 121.3290 51.3925 20.2516 176.9801 47 R 5.1441 9.1673 117.1796 54.0716 34.1366 175.9115 48 G 4.0905 7.6435 106.5037 47.0581 0.0000 171.4576 49 V 5.4128 8.0659 112.8016 60.0022 35.0843 175.2384 50 F 5.1313 8.6538 116.0333 55.0479 41.8225 171.9441 51 P 3.4519 0.0000 0.0000 62.0907 31.6922 177.0741 52 A 2.5800 8.2046 127.0737 55.2788 18.0900 178.8253 53 Y 4.3266 7.7343 108.9774 59.6796 38.0077 176.0643 54 Y 4.4169 8.4839 117.8319 58.4767 38.3458 174.4776 55 A 5.2653 7.8179 121.2260 50.3185 22.8965 175.5519 56 I 4.6240 8.6469 112.5983 58.9613 41.0883 174.1275 57 E 4.5441 8.5951 124.4746 55.5112 30.3866 176.1823 58 V 4.0015 8.4058 121.2034 61.1130 32.4219 176.2665 59 T 4.4364 8.3273 113.5828 61.0906 69.1953 174.6501 60 K 4.1404 7.8837 126.7328 57.5531 32.7069 176.6437 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -1 G 8.34 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 7.91 4.60 0.00 4.01 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 1 E 8.12 4.26 0.00 2.11 1.91 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 2.40 2.36 0.00 2 Q 8.58 4.49 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 3 T 9.35 4.59 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 1.31 0.00 0.00 4 H 8.03 5.55 0.00 3.22 3.44 0.00 5.79 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.85 5.10 0.00 1.85 1.69 0.00 3.06 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.78 0.00 6 A 9.13 4.62 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.65 4.29 1.31 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 -0.36 0.71 0.00 0.00 8 F 7.64 5.18 0.00 2.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.85 4.40 0.00 1.90 1.96 0.00 3.50 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 10 F 9.44 5.01 0.00 3.07 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 11 V 8.00 4.26 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 0.76 0.00 0.00 0.89 0.00 0.00 12 P 0.00 4.14 0.00 1.99 1.95 0.00 3.51 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 13 R 9.39 4.49 0.00 1.61 1.71 0.00 3.10 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 14 H 8.07 5.02 0.00 3.50 3.22 0.00 5.82 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.88 4.11 0.00 1.97 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 0.00 2.32 2.31 0.00 16 D 8.01 4.66 0.00 2.80 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 17 E 7.96 5.13 0.00 2.18 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.46 0.00 18 L 8.90 4.76 0.00 1.78 1.90 1.05 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.93 4.40 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 20 L 9.20 5.07 0.00 1.69 1.46 0.24 0.72 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 21 E 9.31 4.99 0.00 2.18 1.81 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 2.21 2.35 0.00 22 V 8.40 3.66 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 0.72 0.00 0.00 1.01 0.00 0.00 23 D 9.15 4.69 0.00 2.77 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 24 D 7.98 4.60 0.00 2.66 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 25 P 0.00 4.78 0.00 2.09 2.06 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 26 L 9.32 5.08 0.00 1.66 1.69 0.87 0.26 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 27 L 8.82 4.96 0.00 1.90 1.75 0.96 0.77 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 28 V 9.10 4.28 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 0.36 0.00 0.00 0.75 0.00 0.00 29 E 9.10 4.30 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 2.35 2.41 0.00 30 L 7.59 4.45 0.00 1.67 1.41 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.51 4.47 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 1.16 1.81 0.00 32 A 8.45 4.22 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 33 E 8.72 3.98 0.00 2.00 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 0.00 2.30 2.29 0.00 34 D 8.19 4.98 0.00 3.03 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 35 Y 8.00 3.51 0.00 3.27 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 36 W 8.31 4.91 0.00 3.32 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 37 Y 8.51 5.18 0.00 1.43 2.26 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 38 E 9.14 5.17 0.00 1.86 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 2.25 2.35 0.00 39 A 9.28 5.26 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.99 5.20 0.00 3.07 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 41 N 8.81 4.39 0.00 2.69 2.51 0.00 0.00 6.66 7.61 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 43 R 8.38 3.14 0.00 1.85 2.08 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 44 T 7.70 4.12 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 1.18 0.00 0.00 45 G 8.43 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 46 A 7.43 4.55 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 47 R 9.17 5.14 0.00 1.76 1.92 0.00 3.43 0.00 0.00 3.31 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.83 0.00 48 G 7.64 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 49 V 8.07 5.41 2.34 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 0.80 0.00 0.00 1.05 0.00 0.00 50 F 8.65 5.13 0.00 2.47 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 3.45 0.00 1.64 1.40 0.00 2.20 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.63 0.00 52 A 8.20 2.58 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 7.73 4.33 0.00 3.08 3.12 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 54 Y 8.48 4.42 0.00 3.27 2.90 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 55 A 7.82 5.27 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 56 I 8.65 4.62 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.89 0.87 0.00 0.00 57 E 8.60 4.54 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 58 V 8.41 4.00 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 0.72 0.00 0.00 0.96 0.00 0.00 59 T 8.33 4.44 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 1.20 0.00 0.00 60 K 7.88 4.14 0.00 1.88 1.83 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.43 7.81