NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 A 4.5203 8.1076 122.4614 52.2259 20.7843 175.0420 7 T 5.0657 8.1658 108.0547 59.7274 72.7550 170.8813 8 A 5.2352 8.7456 123.1239 50.5895 23.8549 176.4982 9 V 4.7568 8.5922 119.3635 59.4461 34.2813 175.0512 10 A 4.2834 8.7307 127.0965 52.2318 18.8605 177.7947 11 L 4.2874 8.9929 122.2572 55.4021 42.4807 176.2574 12 Y 4.9156 7.7664 114.8966 56.1727 42.1481 174.6022 13 N 4.9292 9.0050 119.0471 53.6447 39.9039 174.6646 14 F 4.8518 9.0020 124.1143 56.5448 41.8160 175.3802 15 A 3.5994 8.5759 129.8738 52.9700 19.0710 177.0289 16 G 3.4128 5.4481 103.4284 46.5308 0.0000 173.2773 17 E 4.2717 7.4114 114.0535 56.7479 31.2345 177.5246 18 Q 4.2713 7.8509 118.3747 54.2120 29.7547 173.5044 19 P 4.4533 0.0000 0.0000 64.4510 31.7857 177.0690 20 G 4.0432 9.0674 111.7273 44.9768 0.0000 172.5867 21 D 5.2872 7.7964 119.4581 54.1522 41.7692 175.6712 22 L 4.5583 9.0605 124.8620 54.4262 42.8570 175.9850 23 A 4.6155 8.6206 128.2652 51.3689 20.3014 175.8168 24 F 4.9554 8.4127 114.5809 56.1196 42.1102 172.9554 25 K 5.1928 9.4918 118.6402 53.9509 35.1774 176.1855 26 K 3.9746 9.4377 124.1643 58.7145 32.3053 176.8537 27 G 4.0399 8.8928 115.2737 45.1915 0.0000 173.5653 28 D 4.4778 8.1061 120.0121 54.5147 42.1334 175.5977 29 V 4.4793 8.2166 122.0975 61.6892 32.9635 174.7902 30 I 4.4685 8.5563 129.5873 59.8908 39.3532 174.9363 31 T 4.5098 8.7018 124.7303 63.0527 69.8290 174.0897 32 I 4.6704 8.5710 128.7147 60.4152 36.8567 175.8158 33 L 4.2784 8.8242 128.9796 57.1661 42.5159 178.0762 34 K 4.6797 7.8748 119.0156 54.9566 35.5832 174.9797 35 K 4.2207 8.1998 125.0131 55.3492 35.7185 175.5086 36 S 4.5536 7.7698 116.3287 56.9428 65.0443 173.4428 37 D 4.6974 8.4903 117.6125 53.3772 39.4822 175.7647 38 S 4.7486 8.2149 114.9712 56.9408 64.6407 173.9278 39 Q 3.8893 8.9184 127.0723 56.7517 28.8838 175.0637 40 N 4.6163 7.9540 113.7879 53.9663 39.0711 173.9195 41 D 4.9595 7.5393 117.7914 52.7599 43.1944 174.4601 42 W 4.6904 8.6372 119.2972 55.1125 30.9629 176.0884 43 W 4.9888 8.0149 123.5696 55.2930 32.7596 174.2262 44 T 5.2185 9.1615 117.6876 62.2712 70.4463 174.5753 45 G 4.6443 9.7740 112.6443 44.9515 0.0000 170.9318 46 R 5.7760 8.8004 119.1463 53.6892 33.4333 173.9470 47 T 4.6102 8.5973 118.6728 61.4998 70.9908 172.8834 48 N 4.0559 9.7107 125.1830 54.6315 35.9836 175.2148 49 G 3.9930 8.4418 103.0040 45.4870 0.0000 173.2863 50 K 4.7523 7.7594 118.4761 54.2849 35.7278 174.5948 51 E 5.2108 9.0347 120.8766 54.1559 33.1428 175.2432 52 G 4.2337 8.1425 110.4362 46.6455 0.0000 171.3090 53 I 5.3018 8.0267 113.4520 60.5756 39.6366 175.0295 54 F 4.9245 8.8826 118.0408 54.7509 41.9663 171.7694 55 P 2.9700 0.0000 0.0000 61.4973 31.0961 177.2095 56 A 3.4223 7.4786 127.6738 54.0326 18.0989 178.1943 57 N 4.5443 7.5381 111.1971 54.1408 37.7815 175.2168 58 Y 4.4880 8.0906 116.9346 58.8218 38.5226 174.8454 59 V 4.9970 7.4176 112.1727 59.4147 35.9652 174.6550 60 R 4.5884 8.7287 122.5088 54.4567 32.0083 175.2706 61 V 4.2371 8.5890 127.2181 62.8688 32.4090 175.7570 62 S 4.4254 8.8804 122.2085 58.5044 62.5932 173.8093 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 6 A 8.11 4.52 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 7 T 8.17 5.07 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 8 A 8.75 5.24 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 9 V 8.59 4.76 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 0.90 0.00 0.00 0.92 0.00 0.00 10 A 8.73 4.28 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 11 L 8.99 4.29 0.00 1.35 1.21 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.77 4.92 0.00 2.77 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 13 N 9.00 4.93 0.00 2.73 2.83 0.00 0.00 6.63 7.45 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 14 F 9.00 4.85 0.00 2.39 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 15 A 8.58 3.60 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 16 G 5.45 3.41 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 0.00 17 E 7.41 4.27 0.00 1.87 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 2.21 2.15 0.00 18 Q 7.85 4.27 0.00 2.31 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 7.07 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 19 P 0.00 4.45 0.00 2.04 2.01 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 20 G 9.07 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 21 D 7.80 5.29 0.00 2.85 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 22 L 9.06 4.56 0.00 1.94 2.02 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.62 4.62 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 24 F 8.41 4.96 0.00 3.19 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 25 K 9.49 5.19 0.00 2.00 1.79 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.53 7.81 26 K 9.44 3.97 0.00 1.73 1.80 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 27 G 8.89 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 28 D 8.11 4.48 0.00 2.68 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 29 V 8.22 4.48 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 0.75 0.00 0.00 0.90 0.00 0.00 30 I 8.56 4.47 1.48 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.29 0.43 0.00 0.00 31 T 8.70 4.51 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 32 I 8.57 4.67 1.98 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.65 0.91 0.00 0.00 33 L 8.82 4.28 0.00 1.62 1.76 0.98 0.61 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 34 K 7.87 4.68 0.00 1.80 1.61 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.41 7.81 35 K 8.20 4.22 0.00 0.79 0.74 0.00 0.86 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.86 0.87 7.81 36 S 7.77 4.55 0.00 4.07 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 37 D 8.49 4.70 0.00 2.83 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 38 S 8.21 4.75 0.00 3.95 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 8.92 3.89 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 1.95 2.33 0.00 40 N 7.95 4.62 0.00 2.72 2.78 0.00 0.00 7.03 8.05 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 41 D 7.54 4.96 0.00 3.10 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.64 4.69 0.00 3.06 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 43 W 8.01 4.99 0.00 2.33 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 44 T 9.16 5.22 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 1.38 0.00 0.00 45 G 9.77 4.64 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 46 R 8.80 5.78 0.00 1.89 1.74 0.00 3.33 0.00 0.00 3.22 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 47 T 8.60 4.61 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 1.26 0.00 0.00 48 N 9.71 4.06 0.00 2.91 2.87 0.00 0.00 7.10 7.65 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 49 G 8.44 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.76 4.75 0.00 1.91 1.70 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.51 7.81 51 E 9.03 5.21 0.00 1.97 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 0.00 2.25 2.41 0.00 52 G 8.14 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 0.00 0.00 0.00 0.00 53 I 8.03 5.30 2.20 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 1.06 0.00 0.00 54 F 8.88 4.92 0.00 3.06 3.28 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 55 P 0.00 2.97 0.00 1.56 0.52 0.00 2.37 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 0.44 0.00 56 A 7.48 3.42 -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 57 N 7.54 4.54 0.00 2.75 2.98 0.00 0.00 6.04 7.55 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 58 Y 8.09 4.49 0.00 3.22 3.32 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 59 V 7.42 5.00 2.12 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 0.49 0.00 0.00 1.03 0.00 0.00 60 R 8.73 4.59 0.00 1.82 1.75 0.00 3.08 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 61 V 8.59 4.24 2.19 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 0.94 0.00 0.00 1.25 0.00 0.00 62 S 8.88 4.43 0.00 3.85 3.76 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