NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9355 8.3549 109.7365 44.0703 0.0000 174.1809 2 S 4.4027 8.4220 115.2505 57.0805 65.3101 172.9404 3 S 4.7579 7.7025 112.5433 55.8164 66.9224 173.3315 4 G 3.6786 8.5288 110.7732 45.5016 0.0000 173.2891 5 S 4.4527 8.4647 118.9495 57.8331 63.8144 172.9841 6 S 3.9525 8.5284 122.2336 57.3994 62.5554 170.7061 7 G 4.1016 8.3587 111.8279 45.0320 0.0000 174.0234 8 R 4.7059 8.5229 118.6742 54.1297 33.0175 174.2874 9 W 5.9649 8.8753 122.0546 54.0682 33.7580 175.2334 10 V 4.9157 8.4069 113.4479 59.9179 35.7237 173.9874 11 E 4.7012 9.4811 126.1615 55.3613 30.4160 174.9314 12 G 4.1291 8.9523 117.7201 45.4163 0.0000 171.7718 13 I 5.9445 9.0798 123.7947 60.0533 41.6975 174.1479 14 T 4.6338 8.0469 111.6996 59.6466 70.2157 172.3514 15 S 3.8167 8.4476 113.8774 60.7742 62.1121 173.7138 16 E 3.8074 7.9876 133.6086 54.5200 28.8815 175.0320 17 G 4.2937 5.5103 120.2755 46.0941 0.0000 171.8517 18 Y 4.8000 6.5896 118.1082 56.8253 39.8742 175.8450 19 H 5.1399 9.5374 121.9503 55.5955 29.1636 174.0811 20 Y 4.7348 8.7843 121.1704 55.1222 41.9573 173.8158 21 Y 5.0627 8.1877 117.0263 56.4518 40.5974 175.0257 22 Y 4.8081 8.8849 125.6257 56.3155 42.0313 173.5636 23 D 4.1854 6.9876 122.5899 51.9418 42.7595 177.4186 24 L 4.2104 7.5426 121.7139 56.7529 41.0710 177.9248 25 I 3.4750 6.7798 118.1564 64.1250 37.4641 176.1896 26 S 4.3891 7.9851 114.9121 60.1005 65.8070 173.5317 27 G 3.5741 7.3386 106.6666 44.7094 0.0000 172.0956 28 A 4.6102 6.9202 122.1712 50.6470 22.2215 177.2780 29 S 5.0429 7.9759 111.8176 57.7275 65.9416 173.4905 30 Q 4.1128 8.4274 120.3645 55.5419 32.3832 174.9615 31 W 4.5371 8.5610 125.9269 59.8732 29.5649 177.0259 32 E 4.1887 8.2475 115.8943 56.3726 29.4951 176.4327 33 K 3.8867 8.2850 121.2556 54.7723 33.0361 174.8253 34 P 3.8698 0.0000 0.0000 61.4023 31.9956 175.5638 35 E 3.6580 8.2793 120.3544 57.9511 30.3878 177.3236 36 G 3.9381 8.5726 114.6039 46.7930 0.0000 172.9983 37 F 4.1817 8.0374 123.0109 61.2421 40.0856 175.4861 38 Q 2.9301 7.9737 114.3653 56.8375 26.3933 173.2906 39 G 3.4527 6.0882 112.3634 43.1550 0.0000 168.3831 40 D 4.7101 7.4694 116.8488 54.4413 43.0708 174.8652 41 L 4.4560 8.3313 126.2149 54.6866 45.5144 175.3392 42 K 3.7583 8.6795 122.5569 57.2067 29.0618 174.4826 43 K 4.0103 7.8293 116.6849 57.8628 33.8084 178.3548 44 T 3.4241 8.5717 120.9229 64.0325 65.3611 170.6772 45 S 4.5379 7.3251 114.5353 57.5334 66.5607 175.1277 46 G 3.9057 8.5023 111.9335 44.5085 0.0000 171.3667 47 P 4.2345 0.0000 0.0000 65.5439 31.7204 176.5373 48 S 4.2589 7.9331 114.7451 57.3391 62.0064 173.2372 49 S 4.5040 8.5680 122.8146 57.5738 64.5412 174.4826 50 G 4.3585 7.8030 106.7727 46.2693 0.0000 173.1582 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 8.35 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 0.00 0.00 0.00 2 S 8.42 4.40 0.00 3.93 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 3 S 7.70 4.76 0.00 3.91 3.78 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 4 G 8.53 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 5 S 8.46 4.45 0.00 3.84 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 6 S 8.53 3.95 0.00 4.06 3.88 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 7 G 8.36 4.10 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 0.00 0.00 0.00 8 R 8.52 4.71 0.00 1.59 1.85 0.00 3.29 0.00 0.00 3.58 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 9 W 8.88 5.96 0.00 3.08 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 10 V 8.41 4.92 2.23 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 0.91 0.00 0.00 1.22 0.00 0.00 11 E 9.48 4.70 0.00 2.68 2.18 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 2.34 2.28 0.00 12 G 8.95 4.13 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 0.00 0.00 0.00 13 I 9.08 5.94 1.92 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.63 0.90 0.00 0.00 14 T 8.05 4.63 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 0.71 0.00 0.00 15 S 8.45 3.82 0.00 3.88 3.86 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 16 E 7.99 3.81 0.00 1.65 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 1.83 2.11 0.00 17 G 5.51 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 0.00 0.00 0.00 0.00 18 Y 6.59 4.80 0.00 3.03 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 19 H 9.54 5.14 0.00 3.00 3.39 0.00 5.71 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.78 4.73 0.00 3.20 3.25 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 21 Y 8.19 5.06 0.00 2.87 2.71 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 22 Y 8.88 4.81 0.00 3.20 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 23 D 6.99 4.19 0.00 1.67 1.63 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 24 L 7.54 4.21 0.00 1.84 2.03 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 25 I 6.78 3.47 1.61 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.28 0.82 0.00 0.00 26 S 7.99 4.39 0.00 3.68 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 27 G 7.34 3.57 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 0.00 0.00 0.00 28 A 6.92 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.98 5.04 0.00 3.75 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 30 Q 8.43 4.11 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 31 W 8.56 4.54 0.00 3.33 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 32 E 8.25 4.19 0.00 2.01 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 2.38 2.39 0.00 33 K 8.29 3.89 0.00 1.77 1.61 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.26 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.00 0.49 7.81 34 P 0.00 3.87 0.00 0.97 0.49 0.00 2.59 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.74 0.00 35 E 8.28 3.66 0.00 1.80 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 2.24 2.31 0.00 36 G 8.57 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 0.00 0.00 0.00 37 F 8.04 4.18 0.00 2.58 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 38 Q 7.97 2.93 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.17 0.00 39 G 6.09 3.45 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 0.00 40 D 7.47 4.71 0.00 2.68 2.59 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 41 L 8.33 4.46 0.00 1.54 1.43 0.91 0.71 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 42 K 8.68 3.76 0.00 1.89 1.80 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.35 7.81 43 K 7.83 4.01 0.00 1.87 1.87 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.54 7.81 44 T 8.57 3.42 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 45 S 7.33 4.54 0.00 3.77 3.67 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 46 G 8.50 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 0.00 0.00 0.00 47 P 0.00 4.23 0.00 2.19 2.19 0.00 3.77 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 1.99 1.95 0.00 48 S 7.93 4.26 0.00 3.86 3.84 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 0.00 0.00 0.00 49 S 8.57 4.50 0.00 4.02 3.84 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 0.00 0.00 0.00 50 G 7.80 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 0.00 0.00 0.00 0.00