NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.6905 8.3249 119.4139 57.4721 40.3730 173.7291 2 E 4.4847 8.5251 121.2149 53.6040 31.8970 174.5521 3 N 4.5999 9.4114 121.2655 53.5791 39.4251 174.3395 4 R 4.6369 8.3459 124.8746 55.9153 31.2164 178.3321 5 V 3.6037 8.6153 121.0150 66.4139 31.2231 177.5915 6 A 4.3003 7.9778 120.9493 54.8013 18.1827 179.3268 7 E 3.9314 8.1599 116.3950 59.4495 29.5238 179.5838 8 K 4.1496 7.8688 118.7792 59.3492 31.9971 179.4108 9 Q 4.1156 8.6104 118.9691 58.7649 28.3974 178.7719 10 K 3.9911 7.9659 119.7044 59.3178 32.6735 178.1113 11 L 3.9211 7.8776 120.5280 58.3559 41.8050 178.7437 12 F 4.3070 8.2874 114.7445 58.7906 39.0395 176.5735 13 Q 4.5353 7.5391 116.3292 54.2847 29.3905 175.1744 14 E 3.9228 7.4018 121.7963 56.6036 30.4284 177.3641 15 D 4.6432 8.4523 127.4280 53.2129 39.6432 175.1885 16 N 4.7703 7.8818 114.0709 51.8907 38.1417 177.0114 17 G 3.9317 8.1808 105.6669 46.0647 0.0000 174.2900 18 L 4.2459 7.9188 120.0743 53.3598 42.5348 175.2308 19 P 4.5587 0.0000 0.0000 62.0047 32.3815 177.5812 20 V 3.6713 8.4846 119.4372 65.2033 31.1759 177.6988 21 H 4.4603 8.2427 113.6254 56.9194 28.6885 175.3575 22 L 4.6526 7.9562 119.2269 54.2033 43.0025 177.8222 23 K 4.1186 8.0073 120.1587 58.2433 32.2933 177.8725 24 G 3.6684 8.9157 107.0692 46.3122 0.0000 172.0447 25 G 3.7008 7.7612 104.9472 44.1569 0.0000 174.0690 26 A 4.0969 8.6867 119.0516 55.1012 18.3640 180.1334 27 T 3.9144 7.9213 114.2650 66.6578 68.4012 176.2423 28 D 4.4468 8.2621 121.0376 57.5600 40.8649 178.6092 29 N 4.4629 8.1485 116.3793 56.2984 38.6299 177.4437 30 I 3.7091 7.6919 120.7148 64.3668 37.1797 178.2852 31 L 3.9982 8.0665 121.1687 58.1753 41.9183 178.1120 32 Y 4.1552 8.4208 119.8742 61.0465 38.7288 178.6181 33 R 3.6846 7.9764 118.7931 58.9110 30.0693 179.2057 34 V 3.5176 8.2368 118.4014 66.2713 31.5033 178.1225 35 T 3.7771 8.0025 115.6531 67.0034 68.2898 176.3523 36 M 3.8879 8.0624 120.3014 58.7722 32.0665 178.4108 37 T 3.8361 7.8564 115.9975 66.5397 68.5398 176.7432 38 L 3.9886 8.0820 121.0817 57.8084 41.5823 179.4469 39 C 4.1277 8.3658 116.9977 62.8857 28.2185 176.2157 40 L 4.1048 8.3070 121.0784 57.7502 41.2030 179.8833 41 G 3.7000 8.5407 106.3074 47.7784 0.0000 176.0667 42 G 3.7451 8.5755 108.3678 47.5124 0.0000 176.0792 43 T 3.9666 8.1443 118.3246 66.5740 68.4249 176.7820 44 L 4.0905 7.9980 120.9118 57.8550 41.5710 178.8124 45 Y 4.4464 8.3574 119.9005 60.8140 38.7022 178.2525 46 S 3.9777 8.3618 115.2381 61.5125 62.8659 176.5855 47 L 3.9929 8.1069 122.5265 57.4836 41.3666 178.5151 48 Y 4.0738 8.0863 119.5161 61.1407 38.7369 177.9579 49 C 3.8788 8.1889 117.4655 62.7856 28.0191 175.8204 50 L 4.0211 8.0764 120.8879 58.4004 41.7164 178.9324 51 G 3.8426 8.3600 105.7541 47.5961 0.0000 175.4322 52 W 4.0462 7.9840 130.2773 60.0459 30.6641 177.4932 53 A 3.9730 8.0796 117.5397 53.1957 18.1266 178.6457 54 S 4.0757 7.4054 112.8520 58.3654 63.5115 174.0414 55 F 4.6930 6.7110 118.7235 54.2118 42.0383 173.2587 56 P 4.2601 0.0000 0.0000 63.1035 31.9010 176.1464 57 H 4.4369 8.2849 116.3749 56.1270 29.4403 173.4857 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 F 8.32 4.69 0.00 3.03 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 2 E 8.53 4.48 0.00 2.06 1.88 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 2.24 2.39 0.00 3 N 9.41 4.60 0.00 2.71 2.78 0.00 0.00 6.87 7.65 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 4 R 8.35 4.64 0.00 1.88 2.02 0.00 3.72 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.56 0.00 5 V 8.62 3.60 2.19 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 1.07 0.00 0.00 0.94 0.00 0.00 6 A 7.98 4.30 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.16 3.93 0.00 2.04 2.02 0.00 0.00 0.00 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 2.42 0.00 8 K 7.87 4.15 0.00 1.98 2.10 0.00 1.92 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.67 1.72 7.81 9 Q 8.61 4.12 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 10 K 7.97 3.99 0.00 1.87 1.93 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.44 7.81 11 L 7.88 3.92 0.00 1.62 1.57 0.65 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.29 4.31 0.00 3.05 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 13 Q 7.54 4.54 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 14 E 7.40 3.92 0.00 1.96 1.80 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 2.29 2.22 0.00 15 D 8.45 4.64 0.00 2.67 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.88 4.77 0.00 2.79 2.98 0.00 0.00 6.37 7.00 0.00 0.00 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 G 8.18 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 18 L 7.92 4.25 0.00 1.73 1.57 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.56 0.00 2.24 2.17 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.86 0.00 20 V 8.48 3.67 2.11 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 0.90 0.00 0.00 0.92 0.00 0.00 21 H 8.24 4.46 0.00 3.30 3.46 0.00 5.47 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.96 4.65 0.00 1.63 1.57 0.72 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.01 4.12 0.00 1.94 2.19 0.00 2.04 0.00 0.00 1.99 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.36 7.81 24 G 8.92 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.76 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.69 4.10 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.92 3.91 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 28 D 8.26 4.45 0.00 2.97 2.93 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 29 N 8.15 4.46 0.00 2.92 2.93 0.00 0.00 7.11 7.42 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 30 I 7.69 3.71 2.04 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 1.43 0.62 0.93 0.00 0.00 31 L 8.07 4.00 0.00 1.94 1.73 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.42 4.16 0.00 3.18 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 3.68 0.00 2.14 1.93 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 34 V 8.24 3.52 2.06 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 1.08 0.00 0.00 0.92 0.00 0.00 35 T 8.00 3.78 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 1.19 0.00 0.00 36 M 8.06 3.89 0.00 1.61 1.41 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 2.48 2.49 0.00 37 T 7.86 3.84 4.34 0.00 0.00 0.00 0.00 0.00 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 38 L 8.08 3.99 0.00 1.79 1.70 0.90 0.90 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 39 C 8.37 4.13 0.00 3.03 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 40 L 8.31 4.10 0.00 1.70 1.71 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.54 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.58 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 43 T 8.14 3.97 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 44 L 8.00 4.09 0.00 1.92 1.79 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.36 4.45 0.00 2.96 3.19 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 46 S 8.36 3.98 0.00 4.07 4.12 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.11 3.99 0.00 1.95 1.81 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.09 4.07 0.00 3.29 3.36 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 49 C 8.19 3.88 0.00 3.00 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 50 L 8.08 4.02 0.00 1.73 1.89 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.36 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 0.00 0.00 0.00 52 W 7.98 4.05 0.00 3.05 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 53 A 8.08 3.97 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.41 4.08 0.00 3.79 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.71 4.69 0.00 2.83 2.76 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 56 P 0.00 4.26 0.00 2.09 1.97 0.00 3.78 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 57 H 8.28 4.44 0.00 2.99 3.22 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00