NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9815 8.3393 109.7367 45.3372 0.0000 172.5898 2 S 4.4988 7.7709 117.9137 55.7742 66.1950 172.3512 3 S 4.6941 8.3915 114.6024 57.4822 68.0392 176.6727 4 G 3.6022 8.8132 110.7337 45.8218 0.0000 176.5627 5 S 4.1288 9.1749 123.9025 58.1426 62.1330 173.1678 6 S 3.9728 8.5177 120.0655 59.2156 62.7821 172.9539 7 G 3.0354 7.8208 119.8912 43.9903 0.0000 172.5387 8 S 4.4942 7.0594 110.9202 57.4044 65.2511 174.6295 9 S 4.5820 8.3802 121.6046 56.3985 63.0132 173.7467 10 K 4.1363 8.3014 127.7178 58.9076 32.7609 176.8107 11 E 3.9415 8.1959 119.0111 59.7096 29.2794 178.7400 12 L 4.0682 7.8497 118.1366 57.3089 41.7476 178.9803 13 L 3.9375 7.3296 117.3749 58.4070 41.5808 178.9487 14 M 4.1654 8.5302 119.1298 58.1803 31.8469 179.0283 15 K 3.8278 7.7807 118.2518 59.4231 32.3240 179.2161 16 L 4.0829 8.1463 120.1615 57.2393 41.7769 178.9583 17 R 3.6070 7.4896 119.0538 59.5132 29.7600 178.4342 18 R 3.9931 7.2030 114.1848 59.0994 29.7698 178.1008 19 K 3.9377 7.8663 118.7109 59.7586 32.0869 178.9644 20 T 4.1658 7.7678 109.9482 65.8980 69.4600 175.7794 21 G 3.9323 7.6101 107.4375 45.0023 0.0000 173.8962 22 Y 4.2065 7.4662 117.3038 57.4754 38.7521 176.4964 23 S 4.3491 8.6533 118.4572 58.7560 64.8677 176.0381 24 F 3.9559 9.0158 121.5788 61.1164 38.5425 178.1419 25 V 3.6618 8.0770 109.8977 65.3178 31.4704 177.7212 26 N 4.3389 8.2278 115.6278 55.6888 38.3738 176.6402 27 C 3.8027 8.2254 117.3466 63.1358 28.4970 176.3456 28 K 3.7555 8.1598 120.8925 59.5207 31.6672 178.4020 29 K 3.6572 8.0929 119.4753 59.5836 32.1474 178.5495 30 A 2.9368 7.4679 120.2374 54.7901 18.2311 179.4454 31 L 3.8969 8.0499 117.9769 57.7490 41.4173 179.5293 32 E 3.9411 7.8025 117.8693 59.6079 29.5854 179.0943 33 T 3.8757 7.8676 115.3505 65.9847 68.4084 175.9939 34 C 4.3034 7.4588 115.5705 60.3673 31.5548 174.7210 35 G 4.0559 8.5470 109.5978 46.3307 0.0000 174.1263 36 G 3.9133 7.6796 104.0327 46.9812 0.0000 174.6988 37 D 4.7182 7.1142 116.7573 51.0967 42.7569 177.0972 38 L 3.8662 8.3225 124.1711 57.8599 41.8947 178.4485 39 K 3.9894 8.1119 119.0432 59.6343 31.1192 178.2668 40 Q 4.2268 8.0581 116.9100 57.6596 28.3835 177.8437 41 A 4.6023 8.4259 122.5410 53.9935 19.4521 178.9168 42 E 4.0338 8.7333 118.2494 59.4074 29.6361 179.1282 43 I 3.9402 7.9629 120.1154 64.5919 37.1481 177.2324 44 W 4.0984 8.1208 129.2916 59.7388 30.2301 177.8088 45 L 4.0794 8.5631 116.8629 58.4648 41.4857 179.3275 46 H 4.3501 7.8786 114.3992 59.1046 28.8675 177.8029 47 K 3.7120 8.0531 119.9592 59.5761 31.9368 178.9169 48 E 3.2979 7.6886 118.7010 59.2215 29.2292 179.4331 49 A 2.0000 6.9188 120.3256 54.5578 18.1847 179.1932 50 Q 3.7532 7.2656 116.5020 59.6868 29.0503 178.7091 51 K 3.9510 7.2682 117.7438 59.1138 32.2329 178.7393 52 E 3.9121 7.9091 119.3276 59.2411 30.1605 179.6035 53 G 4.1132 7.6371 106.7129 45.9311 0.0000 175.0770 54 W 4.5106 7.7446 120.0101 59.2059 29.6787 176.8766 55 S 4.8813 7.8645 111.0783 55.9383 63.9787 173.4597 56 K 3.9250 8.9077 127.5558 59.6069 32.1536 176.5998 57 A 3.8722 7.7829 120.0332 51.5324 19.1599 176.6496 58 A 4.2216 8.3433 124.0385 51.7280 19.0812 177.9225 59 S 4.1464 8.6391 120.5966 62.2460 63.2245 173.6571 60 G 3.0077 7.7047 112.1335 43.8989 0.0000 168.8505 61 P 4.2816 0.0000 0.0000 63.0094 31.8115 176.9645 62 S 4.8007 8.3566 118.7103 56.5351 66.0473 173.8187 63 S 4.5386 8.4814 118.0687 57.6848 64.3463 174.9087 64 G 4.3653 8.6062 109.9662 46.2939 0.0000 173.2247 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 8.34 3.98 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 0.00 0.00 0.00 2 S 7.77 4.50 0.00 4.01 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 8.39 4.69 0.00 3.95 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 4 G 8.81 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.17 4.13 0.00 3.87 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 6 S 8.52 3.97 0.00 3.82 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 7 G 7.82 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 0.00 0.00 0.00 8 S 7.06 4.49 0.00 3.78 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 9 S 8.38 4.58 0.00 3.99 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.30 4.14 0.00 1.81 1.83 0.00 1.82 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.42 7.81 11 E 8.20 3.94 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 12 L 7.85 4.07 0.00 1.69 1.69 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.33 3.94 0.00 1.93 1.97 1.01 1.13 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 14 M 8.53 4.17 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.86 0.00 15 K 7.78 3.83 0.00 1.95 1.84 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.59 7.81 16 L 8.15 4.08 0.00 1.82 1.65 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.49 3.61 0.00 1.58 1.61 0.00 3.00 0.00 0.00 2.84 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.00 18 R 7.20 3.99 0.00 1.88 2.01 0.00 3.13 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 19 K 7.87 3.94 0.00 1.91 1.90 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.48 1.61 7.81 20 T 7.77 4.17 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 21 G 7.61 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 22 Y 7.47 4.21 0.00 3.01 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.65 4.35 0.00 3.88 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.02 3.96 0.00 3.08 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 25 V 8.08 3.66 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 0.79 0.00 0.00 0.93 0.00 0.00 26 N 8.23 4.34 0.00 2.99 2.61 0.00 0.00 6.84 7.33 0.00 0.00 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 C 8.23 3.80 0.00 3.08 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 28 K 8.16 3.76 0.00 2.00 1.93 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.47 7.81 29 K 8.09 3.66 0.00 1.76 1.53 0.00 1.88 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.14 1.36 7.81 30 A 7.47 2.94 1.36 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 31 L 8.05 3.90 0.00 1.83 1.66 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.80 3.94 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 33 T 7.87 3.88 3.56 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 0.00 0.00 0.00 1.12 0.00 0.00 34 C 7.46 4.30 0.00 3.12 3.09 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 0.00 0.00 0.00 35 G 8.55 4.06 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 0.00 0.00 0.00 0.00 36 G 7.68 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 37 D 7.11 4.72 0.00 2.65 2.57 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 38 L 8.32 3.87 0.00 1.70 1.74 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.11 3.99 0.00 1.84 1.78 0.00 1.74 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.56 7.81 40 Q 8.06 4.23 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 41 A 8.43 4.60 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.73 4.03 0.00 2.12 2.16 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 2.41 2.43 0.00 43 I 7.96 3.94 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.96 0.00 0.00 44 W 8.12 4.10 0.00 3.74 3.28 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 0.00 45 L 8.56 4.08 0.00 1.89 1.57 1.08 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 46 H 7.88 4.35 0.00 3.43 3.38 0.00 5.63 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 47 K 8.05 3.71 0.00 1.82 1.58 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.49 7.81 48 E 7.69 3.30 0.00 1.24 1.28 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 1.47 1.47 0.00 49 A 6.92 2.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.27 3.75 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 51 K 7.27 3.95 0.00 1.65 1.62 0.00 1.60 0.00 0.00 1.44 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.28 7.81 52 E 7.91 3.91 0.00 1.16 1.86 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 2.13 2.40 0.00 53 G 7.64 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 54 W 7.74 4.51 0.00 3.59 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 55 S 7.86 4.88 0.00 3.95 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 56 K 8.91 3.93 0.00 1.77 1.84 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.41 7.81 57 A 7.78 3.87 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.34 4.22 1.23 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 0.00 0.00 0.00 59 S 8.64 4.15 0.00 3.80 3.97 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 0.00 0.00 0.00 60 G 7.70 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 0.00 0.00 0.00 61 P 0.00 4.28 0.00 2.15 2.21 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 62 S 8.36 4.80 0.00 3.82 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 63 S 8.48 4.54 0.00 3.84 3.77 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 0.00 0.00 0.00 64 G 8.61 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 0.00 0.00 0.00 0.00