NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2954 8.2993 121.7893 56.7498 33.3619 173.6181 2 C 4.9299 8.1429 117.3538 54.1971 42.8072 171.5050 3 L 4.4074 9.2111 122.8854 54.3933 43.0572 178.6543 4 A 4.0536 8.1338 125.9905 50.8032 20.8749 176.1305 5 E 3.5406 7.9026 113.4852 57.3033 30.2185 176.4291 6 A 3.5319 8.6250 125.0602 53.2593 16.7889 176.7481 7 A 4.7054 7.4585 120.8316 51.0674 21.7232 177.0180 8 D 4.8707 8.6879 122.1442 54.8294 41.8967 174.4243 9 C 5.1543 9.0543 119.3680 54.1675 44.9907 173.5846 10 S 4.8009 8.4979 115.4135 56.3154 66.7894 172.2938 11 P 4.0662 0.0000 0.0000 65.3542 30.8042 176.7304 12 W 4.5600 8.0743 115.3933 58.0814 31.1138 177.4165 13 S 4.7266 8.1895 113.3866 56.5569 62.0560 173.0027 14 G 3.8352 6.9545 117.5169 45.1251 0.0000 171.6443 15 D 4.4038 8.2192 124.6320 53.3117 44.0569 174.7105 16 S 4.4882 8.0963 117.5210 58.2051 64.1046 174.8399 17 C 4.9905 8.6906 121.4392 56.8130 42.1189 174.4083 18 C 4.6812 9.4033 120.8668 57.1838 41.0552 173.5802 19 K 4.7225 8.6696 121.4803 55.5188 32.7176 174.7858 20 P 4.7700 0.0000 0.0000 63.1016 32.0081 175.4411 21 Y 4.5277 7.6610 116.4920 58.9557 38.8118 175.2248 22 L 4.8502 8.6952 124.0418 53.0355 45.8715 174.6827 23 C 4.8803 8.9586 126.2551 56.7759 44.0559 172.4113 24 S 4.7599 9.0735 122.2271 56.5458 64.4791 173.7977 25 C 5.5003 8.3621 122.5942 55.4745 38.6323 175.1876 26 I 4.1816 7.5107 115.6739 61.1395 36.9755 177.6606 27 F 4.0809 8.6750 113.8764 59.2811 36.7781 175.3966 28 F 4.7900 7.9392 117.4349 55.8081 42.4158 173.7634 29 Y 4.5499 8.7260 125.7606 56.0041 39.6281 173.1534 30 P 4.3011 0.0000 0.0000 60.9972 33.6684 175.4393 31 C 4.9344 8.2453 115.8202 57.0630 39.9234 173.1585 32 S 5.1191 8.6605 115.4774 57.0067 66.5442 172.7773 33 C 4.9311 9.6195 122.1984 57.2635 41.2076 173.0012 34 R 5.0374 9.0023 122.6172 53.1185 33.5664 173.5989 35 P 5.1175 0.0000 0.0000 63.0416 32.0360 175.8925 36 K 4.2422 8.4375 122.9839 56.4450 32.4682 175.5261 37 G 3.6237 8.8026 120.8257 45.6554 0.0000 173.2990 38 W 4.2605 8.4922 124.7256 56.7803 29.2280 176.0199 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 K 8.30 4.30 0.00 1.73 1.96 0.00 1.92 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.38 7.81 2 C 8.14 4.93 0.00 3.16 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 3 L 9.21 4.41 0.00 1.54 1.56 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.13 4.05 1.02 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 0.00 0.00 0.00 0.00 0.00 5 E 7.90 3.54 0.00 1.95 1.60 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 2.08 2.18 0.00 6 A 8.63 3.53 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 7 A 7.46 4.71 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.69 4.87 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 9.05 5.15 0.00 2.88 2.94 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 0.00 0.00 0.00 10 S 8.50 4.80 0.00 4.02 3.85 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 0.00 0.00 0.00 0.00 11 P 0.00 4.07 0.00 0.49 1.53 0.00 3.73 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.71 0.00 12 W 8.07 4.56 0.00 3.45 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 13 S 8.19 4.73 0.00 3.98 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 6.95 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 15 D 8.22 4.40 0.00 2.58 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.10 4.49 0.00 3.82 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 17 C 8.69 4.99 0.00 3.05 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 0.00 18 C 9.40 4.68 0.00 3.04 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 19 K 8.67 4.72 0.00 1.75 1.71 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.37 7.81 20 P 0.00 4.77 0.00 2.06 2.03 0.00 2.95 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 21 Y 7.66 4.53 0.00 2.95 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 22 L 8.70 4.85 0.00 1.77 1.49 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 23 C 8.96 4.88 0.00 3.01 2.98 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 24 S 9.07 4.76 0.00 3.91 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 25 C 8.36 5.50 0.00 2.96 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 26 I 7.51 4.18 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.98 0.97 0.00 0.00 27 F 8.68 4.08 0.00 3.28 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.94 4.79 0.00 3.01 2.98 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 29 Y 8.73 4.55 0.00 2.86 2.91 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 30 P 0.00 4.30 0.00 1.93 0.73 0.00 3.66 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 31 C 8.25 4.93 0.00 3.14 3.11 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 32 S 8.66 5.12 0.00 3.78 3.82 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 0.00 0.00 0.00 33 C 9.62 4.93 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 34 R 9.00 5.04 0.00 1.51 1.42 0.00 3.00 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 35 P 0.00 5.12 0.00 2.32 2.32 0.00 3.35 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.80 0.00 36 K 8.44 4.24 0.00 1.99 1.70 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.53 7.81 37 G 8.80 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 38 W 8.49 4.26 0.00 3.35 3.02 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 0.00 0.00 0.00