NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8676 8.3501 109.7350 45.1649 0.0000 174.2750 2 A 3.8464 8.4879 127.9152 50.2881 18.8472 176.0592 3 T 4.1655 8.6034 113.9943 60.1063 69.2922 173.0019 4 A 4.0711 8.1883 130.0185 51.9861 19.1015 177.2289 5 V 3.9310 8.1740 115.1386 61.2551 32.5773 175.4299 6 S 3.7282 7.9888 121.5550 59.3352 66.0807 174.4441 7 E 3.2621 7.8579 110.5066 55.9001 25.2383 170.9744 8 W 5.2409 7.8032 117.4741 55.3734 32.4778 174.8089 9 T 4.6675 8.5380 120.0254 60.8034 70.0707 172.1591 10 E 4.7976 8.6790 121.0806 54.7981 31.6261 175.5439 11 Y 4.1359 8.8373 122.3830 55.9645 41.3449 174.6550 12 K 5.3169 8.7488 124.5419 54.5845 33.4256 176.8883 13 T 4.6091 8.6190 115.2986 60.2528 70.7967 175.7886 14 A 4.0317 8.7679 124.7646 54.6938 18.4651 178.1960 15 D 4.5639 8.1578 113.4934 53.6549 40.0298 176.6921 16 G 3.8006 8.3871 108.4211 46.1944 0.0000 172.9377 17 K 4.4816 7.5847 121.3880 55.0858 34.0854 175.7427 18 T 4.5296 8.7351 124.9102 62.8662 68.0437 173.3837 19 Y 5.8087 8.6680 124.6537 54.8050 41.4176 174.2799 20 Y 5.3688 9.3780 117.9739 55.8276 41.1150 174.5356 21 Y 4.7521 8.5100 123.7525 55.3707 41.0472 173.7228 22 N 4.8819 9.0406 126.9922 54.6195 39.6530 174.4657 23 N 4.4851 8.8793 125.2403 54.2842 39.2806 176.0104 24 R 4.5010 8.2286 117.6305 59.2328 30.1552 177.2300 25 T 4.4858 8.6739 105.1050 60.6256 69.5552 172.4052 26 L 3.4325 8.1297 126.4705 55.6848 39.3376 172.3370 27 E 4.6781 8.6290 123.2962 54.2150 34.1949 173.2583 28 S 5.4017 8.9855 118.6691 56.9799 65.9353 174.1581 29 T 4.3978 9.1984 112.3043 60.1707 71.8155 173.9322 30 W 4.4120 9.3768 125.6488 58.1865 29.2458 177.9927 31 E 4.9031 7.8530 122.4178 54.7925 31.7688 175.1450 32 K 3.3272 8.6760 117.9903 56.5075 32.3800 175.2563 33 P 4.2204 0.0000 0.0000 62.0688 32.1535 176.5208 34 Q 4.0567 8.3649 117.2838 59.6107 28.6297 178.1062 35 E 4.0312 8.0303 115.0429 58.1834 29.8826 176.6310 36 L 4.2801 7.6242 120.1086 54.0350 41.2295 176.3710 37 K 4.1613 8.3873 124.5044 56.3851 32.4403 176.5197 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 3.87 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 0.00 0.00 0.00 2 A 8.49 3.85 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 3 T 8.60 4.17 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 1.19 0.00 0.00 4 A 8.19 4.07 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 5 V 8.17 3.93 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 0.82 0.00 0.00 1.01 0.00 0.00 6 S 7.99 3.73 0.00 3.66 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 7 E 7.86 3.26 0.00 1.80 1.77 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 2.09 2.02 0.00 8 W 7.80 5.24 0.00 3.26 3.17 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 9 T 8.54 4.67 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 1.58 0.00 0.00 10 E 8.68 4.80 0.00 1.76 1.71 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 2.14 2.31 0.00 11 Y 8.84 4.14 0.00 1.82 2.14 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 12 K 8.75 5.32 0.00 1.59 1.74 0.00 1.72 0.00 0.00 2.15 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.14 7.81 13 T 8.62 4.61 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 14 A 8.77 4.03 1.34 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 0.00 0.00 15 D 8.16 4.56 0.00 2.84 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 16 G 8.39 3.80 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 0.00 0.00 0.00 17 K 7.58 4.48 0.00 2.65 1.96 0.00 1.68 0.00 0.00 1.78 0.00 0.00 3.25 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.96 1.80 7.81 18 T 8.74 4.53 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 0.96 0.00 0.00 19 Y 8.67 5.81 0.00 3.15 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 20 Y 9.38 5.37 0.00 2.89 2.98 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 21 Y 8.51 4.75 0.00 2.49 2.73 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 0.00 0.00 0.00 0.00 22 N 9.04 4.88 0.00 3.33 2.92 0.00 0.00 7.31 6.91 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 23 N 8.88 4.49 0.00 2.78 2.70 0.00 0.00 7.42 8.21 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 24 R 8.23 4.50 0.00 1.45 1.92 0.00 3.16 0.00 0.00 3.83 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.40 0.00 25 T 8.67 4.49 4.22 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 1.19 0.00 0.00 26 L 8.13 3.43 0.00 1.76 1.68 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.63 4.68 0.00 2.03 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 0.00 2.21 2.30 0.00 28 S 8.99 5.40 0.00 3.60 3.55 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 29 T 9.20 4.40 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 1.06 0.00 0.00 30 W 9.38 4.41 0.00 3.36 3.21 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 31 E 7.85 4.90 0.00 2.18 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 0.00 2.24 2.29 0.00 32 K 8.68 3.33 0.00 1.69 1.81 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.53 7.81 33 P 0.00 4.22 0.00 1.26 1.16 0.00 2.76 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.97 0.00 34 Q 8.36 4.06 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.14 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 35 E 8.03 4.03 0.00 2.13 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 2.37 2.31 0.00 36 L 7.62 4.28 0.00 1.37 1.06 0.97 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.39 4.16 0.00 1.75 1.65 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.53 7.81