NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1581 8.1600 109.1380 45.1549 0.0000 174.2211 2 I 3.2037 8.0933 117.9701 63.3675 37.7309 172.1960 3 V 3.0200 8.5564 119.9083 66.0472 31.1668 176.8886 4 E 4.7595 7.8118 118.3563 57.7337 29.6671 178.4212 5 Q 4.0931 8.6981 117.9060 58.6058 29.0640 177.0013 6 C 4.7219 8.8189 115.6488 57.0084 41.2728 173.9268 7 C 4.5504 7.9612 118.6039 60.5728 33.1489 174.4494 8 T 4.3499 7.8277 107.5452 61.8113 69.6887 173.8953 9 S 4.9925 7.4000 117.1184 57.2028 63.8926 172.4967 10 I 4.7504 8.1178 111.1243 59.4214 40.4427 172.7871 11 C 4.9947 8.3311 114.9194 54.1142 46.3504 172.7304 12 S 4.8256 8.2839 113.5095 56.3693 63.2779 174.3349 13 L 3.9477 8.6583 128.1579 58.3918 42.0269 177.9603 14 Y 4.0895 8.3946 116.4021 60.6023 38.4295 177.7153 15 Q 4.0074 8.5597 121.1491 59.1913 29.6594 177.9957 16 L 3.8812 8.2735 117.4337 58.1540 41.9790 179.2780 17 E 4.1427 8.0831 117.5209 58.4903 29.6982 178.5188 18 N 4.0019 8.4582 117.0818 56.0546 38.5284 175.2011 19 Y 4.6761 7.6780 111.8241 57.7704 38.5001 175.4624 20 C 4.5373 7.9192 118.0686 58.8179 29.3257 173.5920 21 N 4.5449 8.5870 118.4058 53.7665 38.1474 175.2421 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 8.16 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 0.00 0.00 0.00 0.00 2 I 8.09 3.20 0.98 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.04 0.72 0.00 0.00 3 V 8.56 3.02 2.05 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 0.99 0.00 0.00 0.87 0.00 0.00 4 E 7.81 4.76 0.00 2.32 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 2.36 2.30 0.00 5 Q 8.70 4.09 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 6 C 8.82 4.72 0.00 2.90 3.10 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 7 C 7.96 4.55 0.00 2.86 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 8 T 7.83 4.35 4.24 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 1.21 0.00 0.00 9 S 7.40 4.99 0.00 3.91 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 10 I 8.12 4.75 1.88 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 1.48 0.73 0.92 0.00 0.00 11 C 8.33 4.99 0.00 3.10 3.29 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 12 S 8.28 4.83 0.00 3.95 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 13 L 8.66 3.95 0.00 1.63 1.64 0.60 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.39 4.09 0.00 3.10 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 15 Q 8.56 4.01 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.67 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 16 L 8.27 3.88 0.00 1.93 1.80 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.08 4.14 0.00 2.14 2.01 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 2.31 2.21 0.00 18 N 8.46 4.00 0.00 2.18 1.93 0.00 0.00 6.84 5.76 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 19 Y 7.68 4.68 0.00 2.97 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 20 C 7.92 4.54 0.00 2.99 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 21 N 8.59 4.54 0.00 2.72 2.74 0.00 0.00 6.81 7.56 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