NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3859 8.1127 119.6565 56.1506 32.4256 173.5943 5 E 4.7665 8.3609 120.1947 53.1667 32.4681 173.3579 6 C 4.1690 9.7519 128.0310 59.7642 32.6480 173.6501 7 D 4.6315 8.5669 124.3885 55.4203 39.3967 175.4921 8 Y 4.5005 7.6242 118.0492 58.7438 41.5722 176.4092 9 C 3.9411 8.0336 114.0320 59.0261 30.7086 175.4684 10 G 3.9944 8.3244 107.3638 44.8720 0.0000 173.4219 11 T 4.3805 7.6251 109.8438 61.2684 70.4883 173.5734 12 D 4.8646 8.5574 122.0668 54.5575 41.8234 176.6869 13 I 4.2002 8.2954 124.0805 59.5564 37.5162 175.2071 14 E 3.8141 8.9482 128.3232 55.6391 29.6012 175.0051 15 P 4.1981 0.0000 0.0000 64.5051 31.4605 175.6754 16 G 3.8736 9.3024 106.7860 46.6037 0.0000 173.1655 17 T 4.4593 7.8468 113.4588 62.9075 72.6448 174.3134 18 G 4.1138 8.9957 109.0477 45.7029 0.0000 172.5603 19 T 4.8067 8.3306 113.2079 61.7731 73.0244 173.3523 20 M 5.1106 8.6949 123.7777 53.8365 34.4314 174.5355 21 F 4.7755 9.2716 130.0703 57.6163 41.0752 174.4372 22 V 4.3285 7.8720 126.5655 61.4595 32.1878 175.2969 23 H 3.9283 8.7727 126.2447 54.9782 29.4309 176.7880 24 K 3.8312 8.6780 122.0078 59.8285 31.8831 177.9611 25 D 4.3960 7.9714 116.1011 54.2850 39.3188 176.5050 26 G 3.8852 7.8232 106.4653 45.2454 0.0000 174.1500 27 A 4.2160 9.8667 122.6529 52.8515 19.6774 176.5966 28 T 5.0487 8.3027 114.5704 62.1462 72.5292 174.1868 29 T 4.6267 8.8412 121.4001 62.0377 72.0322 172.8125 30 H 5.0314 9.7280 125.3193 55.5172 30.2985 174.8959 31 F 5.2734 9.5851 121.4061 55.9424 41.9837 176.1180 32 C 4.3899 9.1465 116.5321 60.2186 30.4727 173.8489 33 S 4.6856 7.6858 113.9996 55.8404 66.6966 175.1151 34 S 4.7492 8.4934 118.4063 60.9293 62.6897 175.9731 35 K 3.7630 8.1086 123.1798 60.0171 31.7284 177.5441 36 C 4.2951 8.0670 115.1932 62.5567 27.9699 176.0040 37 E 2.7136 7.8617 119.5276 59.3122 29.0545 179.7802 38 N 4.1726 8.5751 116.6483 56.4255 38.5433 177.3315 39 N 4.4286 8.2965 117.7801 56.0256 38.5416 177.3917 40 A 4.1316 8.0494 122.6117 55.4776 18.3567 179.3082 41 D 4.2520 8.0195 116.1950 57.5665 40.9381 178.8028 42 L 4.2105 7.5532 117.2861 55.7897 41.8050 177.9784 43 G 4.0742 8.6373 107.8047 45.0030 0.0000 174.4200 44 R 4.1745 7.3107 117.2213 56.1274 30.8380 175.6598 45 E 4.6239 8.5279 120.0292 54.2801 31.6482 176.9269 46 A 3.4124 8.0803 126.7056 55.3001 18.4478 179.6597 47 R 3.7996 7.7263 113.4115 59.1365 30.1539 177.3177 48 N 4.4744 8.2463 113.2651 53.5317 39.2335 174.8434 49 L 4.4701 7.3197 120.0303 52.7941 41.7989 177.1756 50 E 3.9945 8.8363 124.7894 58.5551 29.5867 178.6351 51 W 4.4629 7.7469 114.4780 58.3447 29.1376 176.9817 52 T 3.5708 6.8938 117.5789 63.1170 68.2284 174.7506 53 D 4.3502 8.8166 126.4323 57.9404 40.8498 177.8989 54 T 3.7596 8.0355 114.5448 66.8531 68.7620 175.0414 55 A 3.9963 7.7479 123.4059 55.3043 18.6831 177.6029 56 R 4.0806 8.0661 118.6381 56.5802 30.0420 176.4290 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 4 R 8.11 4.39 0.00 1.78 1.90 0.00 3.01 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 5 E 8.36 4.77 0.00 1.93 1.74 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 2.11 2.49 0.00 6 C 9.75 4.17 0.00 3.07 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.57 4.63 0.00 2.65 2.60 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 8 Y 7.62 4.50 0.00 2.77 2.96 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 9 C 8.03 3.94 0.00 3.05 3.26 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 10 G 8.32 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 0.00 0.00 0.00 11 T 7.63 4.38 4.29 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 1.31 0.00 0.00 12 D 8.56 4.86 0.00 2.61 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.30 4.20 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 0.97 0.00 0.00 14 E 8.95 3.81 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 15 P 0.00 4.20 0.00 2.22 2.09 0.00 3.94 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 16 G 9.30 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 17 T 7.85 4.46 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 G 9.00 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 19 T 8.33 4.81 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 20 M 8.69 5.11 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.41 0.00 21 F 9.27 4.78 0.00 3.28 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 22 V 7.87 4.33 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 0.73 0.00 0.00 0.86 0.00 0.00 23 H 8.77 3.93 0.00 3.36 3.17 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.68 3.83 0.00 1.73 1.86 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.44 7.81 25 D 7.97 4.40 0.00 2.81 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 26 G 7.82 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.87 4.22 1.16 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 28 T 8.30 5.05 4.25 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 1.19 0.00 0.00 29 T 8.84 4.63 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 30 H 9.73 5.03 0.00 3.08 3.27 0.00 5.75 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.59 5.27 0.00 2.94 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 32 C 9.15 4.39 0.00 3.17 3.16 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 33 S 7.69 4.69 0.00 4.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.49 4.75 0.00 3.98 4.10 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 35 K 8.11 3.76 0.00 1.77 1.90 0.00 1.44 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.42 1.38 7.81 36 C 8.07 4.30 0.00 3.47 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 37 E 7.86 2.71 0.00 1.72 1.31 0.00 0.00 0.00 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 2.18 0.00 38 N 8.58 4.17 0.00 2.82 2.79 0.00 0.00 7.12 7.57 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 39 N 8.30 4.43 0.00 3.11 3.18 0.00 0.00 6.94 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.05 4.13 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.02 4.25 0.00 2.66 2.68 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 42 L 7.55 4.21 0.00 1.83 1.75 0.94 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.64 4.07 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 0.00 0.00 0.00 44 R 7.31 4.17 0.00 2.20 2.00 0.00 3.25 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 45 E 8.53 4.62 0.00 1.96 1.79 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 2.34 2.29 0.00 46 A 8.08 3.41 0.45 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 47 R 7.73 3.80 0.00 1.72 1.92 0.00 3.13 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 48 N 8.25 4.47 0.00 2.74 2.84 0.00 0.00 6.96 7.40 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 49 L 7.32 4.47 0.00 1.20 1.05 1.29 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.84 3.99 0.00 2.04 2.07 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 2.32 2.32 0.00 51 W 7.75 4.46 0.00 3.60 3.24 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 52 T 6.89 3.57 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 0.92 0.00 0.00 53 D 8.82 4.35 0.00 2.78 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.04 3.76 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 1.05 0.00 0.00 55 A 7.75 4.00 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 56 R 8.07 4.08 0.00 1.88 1.84 0.00 3.21 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00