NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.1226 8.2431 120.8678 57.3816 30.0226 172.3388 2 G 3.7535 8.7544 114.5441 43.0049 0.0000 169.8590 3 K 4.3816 8.7166 125.2450 56.7548 34.1709 174.7287 4 W 5.1012 8.4685 119.4001 55.1124 31.8653 174.1297 5 T 4.5563 8.5953 109.3686 61.1027 69.7275 173.0267 6 Y 4.5721 8.1751 127.7241 59.1149 38.5757 175.9298 7 N 4.9115 7.4531 114.2919 52.3489 39.3325 175.2913 8 G 4.0033 8.2319 100.1704 46.2174 0.0000 172.0789 9 I 4.4749 7.1380 118.8648 58.9036 40.8400 174.5405 10 T 4.7290 8.4800 126.4760 62.9923 68.2521 174.1015 11 Y 4.1500 8.0942 124.4489 57.2301 39.7729 174.3863 12 E 4.5129 8.7001 119.8051 54.2150 33.6160 176.3301 13 G 4.2009 8.8024 108.6853 47.0624 0.0000 175.3565 14 G 3.9311 8.6630 109.9473 46.2253 0.0000 173.8233 15 G 4.1462 9.0877 104.7213 43.7553 0.0000 172.2105 16 G 3.6817 8.0294 108.2562 43.6727 0.0000 173.9349 17 S 4.4467 8.2928 121.2406 57.3564 64.7777 173.9953 18 A 4.2895 8.2254 123.4154 54.2559 19.8371 179.7148 19 A 4.1402 7.8921 117.5948 54.9700 18.4689 179.2162 20 E 3.5964 8.2391 115.2119 58.3394 29.2564 178.8258 21 A 3.9154 7.7168 123.1768 55.7314 18.3911 179.2145 22 Y 4.2018 7.8763 115.8332 60.0953 37.9687 177.7853 23 A 3.3728 6.5204 121.9586 54.6389 18.2092 179.2656 24 K 3.7736 8.1839 116.0503 59.8335 32.4276 179.3237 25 R 4.0599 7.5358 116.3828 59.5274 30.1312 179.1271 26 I 3.6776 8.3095 119.5754 64.1649 36.7919 177.9765 27 A 4.0428 7.9256 121.4170 55.5571 18.3320 179.3371 28 E 4.0132 8.6712 116.8190 59.3323 29.4915 178.9606 29 A 3.9888 7.9749 119.3959 55.7730 18.4447 178.7881 30 M 4.0497 8.2405 115.8009 57.8148 32.5499 177.4474 31 A 4.1338 7.2842 120.3636 52.5528 19.1634 176.4024 32 K 4.3960 8.0044 119.3162 55.7957 35.0496 175.6383 33 G 3.7481 8.5683 110.5995 45.6693 0.0000 173.0962 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 R 8.24 4.12 0.00 1.80 1.98 0.00 3.21 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 2 G 8.75 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 0.00 0.00 0.00 3 K 8.72 4.38 0.00 1.89 1.87 0.00 1.18 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.25 7.81 4 W 8.47 5.10 0.00 3.49 3.20 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 0.00 5 T 8.60 4.56 4.28 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 1.23 0.00 0.00 6 Y 8.18 4.57 0.00 2.19 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 7 N 7.45 4.91 0.00 2.82 2.70 0.00 0.00 6.97 8.40 0.00 0.00 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 G 8.23 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 9 I 7.14 4.47 1.89 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.48 1.14 0.00 0.00 10 T 8.48 4.73 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 1.17 0.00 0.00 11 Y 8.09 4.15 0.00 1.43 2.52 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 12 E 8.70 4.51 0.00 1.76 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 2.20 2.24 0.00 13 G 8.80 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 0.00 0.00 0.00 0.00 14 G 8.66 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 0.00 0.00 0.00 15 G 9.09 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.03 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 17 S 8.29 4.45 0.00 3.78 3.73 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 18 A 8.23 4.29 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 19 A 7.89 4.14 1.38 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 0.00 0.00 0.00 20 E 8.24 3.60 0.00 2.03 2.10 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 2.35 2.28 0.00 21 A 7.72 3.92 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 0.00 0.00 22 Y 7.88 4.20 0.00 3.15 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 23 A 6.52 3.37 0.76 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 0.00 0.00 24 K 8.18 3.77 0.00 1.73 1.91 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.65 7.81 25 R 7.54 4.06 0.00 2.20 2.01 0.00 3.17 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 26 I 8.31 3.68 2.08 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 1.58 1.08 0.99 0.00 0.00 27 A 7.93 4.04 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 28 E 8.67 4.01 0.00 2.13 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 2.33 2.33 0.00 29 A 7.97 3.99 1.38 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 0.00 0.00 0.00 30 M 8.24 4.05 0.00 1.96 2.41 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.61 0.00 31 A 7.28 4.13 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.00 4.40 0.00 1.68 1.63 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.39 7.81 33 G 8.57 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 0.00 0.00 0.00