NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7316 8.4393 118.1642 56.7349 41.0304 173.4100 2 S 3.9112 8.7228 121.0395 60.7014 62.6068 173.5540 3 N 4.1516 8.5839 118.5461 53.5915 39.6863 176.3762 4 L 3.6545 7.6580 118.0118 55.2346 39.3335 174.9257 5 S 4.7126 7.0712 112.4829 58.7495 70.0800 176.0058 6 T 3.8452 7.9320 115.9471 66.7578 68.5863 177.1797 7 C 4.2368 8.0978 119.9625 59.6891 44.9405 175.7556 8 V 3.5579 7.7956 120.2537 64.9209 30.9308 178.0407 9 L 4.0593 7.9973 119.8241 57.2145 41.3762 179.6891 10 G 3.6152 7.9397 105.5584 47.9070 0.0000 175.9713 11 K 4.0181 8.1989 121.3381 58.9173 32.0613 179.5653 12 L 3.9360 8.1003 119.4718 57.7506 41.5358 179.4784 13 S 3.9521 8.2098 113.2381 61.3082 62.3200 175.9864 14 Q 3.8374 8.1014 122.2768 58.9815 28.8105 177.5609 15 E 3.8557 8.2381 120.4462 59.4719 29.7698 178.8096 16 L 3.9118 7.8204 118.6493 58.0490 41.6115 179.1163 17 H 4.1542 8.0790 115.9891 58.9248 28.7204 177.7742 18 K 3.3334 7.8460 120.1107 59.3193 31.7452 179.5244 19 L 4.0952 7.2959 119.5705 57.8744 40.3503 179.0991 20 Q 4.0541 7.5135 118.2689 59.0571 28.8973 177.9578 21 T 3.9997 7.5996 115.5558 65.2170 68.7856 174.1447 22 Y 4.8938 6.9025 118.0903 54.2001 40.6202 173.9271 23 P 4.1613 0.0000 0.0000 64.9951 31.5461 177.2391 24 R 4.5045 7.7070 122.4804 56.7246 31.1742 175.2447 25 T 4.4579 8.2321 123.6765 62.8433 70.1831 173.7663 26 D 4.3439 7.9372 123.8657 54.8642 37.8759 174.4336 27 V 3.8974 7.6685 119.1348 62.3963 31.4282 175.2241 28 G 3.5211 8.1809 115.3307 43.6941 0.0000 173.2034 29 A 3.8006 7.8254 123.3106 52.3304 17.1932 178.1817 30 G 4.0013 7.2994 103.6550 46.5741 0.0000 176.7408 31 T 4.5745 7.1274 107.8082 58.8756 69.0321 172.7995 32 P 4.4000 0.0000 0.0000 63.7763 31.4034 177.2532 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 C 8.44 4.73 0.00 2.98 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 2 S 8.72 3.91 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.58 4.15 0.00 2.71 2.91 0.00 0.00 7.01 7.85 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 4 L 7.66 3.65 0.00 1.75 1.72 0.92 0.77 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 5 S 7.07 4.71 0.00 3.80 3.65 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 0.00 0.00 0.00 0.00 6 T 7.93 3.85 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 7 C 8.10 4.24 0.00 2.99 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 8 V 7.80 3.56 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.92 0.00 0.00 9 L 8.00 4.06 0.00 1.80 1.75 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.94 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.20 4.02 0.00 1.94 1.86 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.65 7.81 12 L 8.10 3.94 0.00 1.81 1.68 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.21 3.95 0.00 3.92 3.93 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 14 Q 8.10 3.84 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.60 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 15 E 8.24 3.86 0.00 2.10 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 0.00 2.28 2.35 0.00 16 L 7.82 3.91 0.00 1.82 1.66 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 17 H 8.08 4.15 0.00 3.29 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.85 3.33 0.00 1.84 1.61 0.00 1.72 0.00 0.00 1.86 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.57 7.81 19 L 7.30 4.10 0.00 1.75 1.74 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 7.51 4.05 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 21 T 7.60 4.00 4.00 0.00 0.00 0.00 0.00 0.00 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 22 Y 6.90 4.89 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.16 0.00 2.12 2.22 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 24 R 7.71 4.50 0.00 1.79 1.85 0.00 3.25 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 25 T 8.23 4.46 3.06 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 0.00 0.00 0.93 0.00 0.00 26 D 7.94 4.34 0.00 2.79 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 3.90 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.05 0.00 0.00 28 G 8.18 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.83 3.80 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 30 G 7.30 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.13 4.57 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 1.23 0.00 0.00 32 P 0.00 4.40 0.00 2.20 2.08 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00