NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2820 8.2493 123.5752 51.8691 20.6757 176.4957 2 T 4.3646 7.4243 103.7342 58.8958 71.4509 171.4635 3 C 4.8495 7.9959 122.4044 55.4354 46.3010 174.4371 4 D 4.8917 8.0795 127.5155 53.7005 38.9275 177.0053 5 L 4.3363 8.6622 114.3798 54.1057 43.2908 175.3577 6 L 3.9446 8.1330 120.2069 54.4634 40.9955 174.2146 7 S 4.7184 6.9419 112.5793 57.1838 66.5415 176.5022 8 G 3.8796 7.6758 113.9521 48.2138 0.0000 175.3578 9 T 4.6957 7.6429 108.7967 60.0439 69.4875 173.1872 10 G 4.1489 8.1724 115.5501 48.0880 0.0000 176.0311 11 I 3.1962 8.1746 120.2746 63.6177 39.9014 175.4408 12 N 4.1064 7.9027 117.3632 54.8557 37.2790 174.2480 13 H 4.4137 8.1429 113.2603 58.2700 29.7740 179.6373 14 S 3.8151 8.3040 115.3337 60.9410 63.1836 175.3028 15 A 3.9582 8.0496 123.2896 55.4270 18.0614 179.9851 16 C 4.1520 8.5568 116.6912 59.7683 41.6669 175.0817 17 A 4.3562 8.3238 123.0380 54.9167 17.8294 178.6715 18 A 3.8641 8.3068 118.6767 55.8394 17.8315 178.9021 19 H 3.9919 8.2125 114.9034 59.7812 29.9669 176.5537 20 C 4.1428 8.3845 117.9130 60.0323 38.3361 175.8202 21 L 4.2068 8.0590 122.1005 57.2467 41.0597 179.3777 22 L 4.0273 7.6140 117.0552 58.0974 41.7123 179.4057 23 R 4.0268 7.2951 115.7169 60.1975 30.9473 175.8090 24 G 3.3043 6.6917 104.8755 45.8397 0.0000 171.3351 25 N 5.1915 7.8366 116.7402 51.3828 42.8522 175.1256 26 R 4.6408 8.2123 113.2505 56.0647 30.0194 174.7176 27 G 4.0748 8.5121 107.6359 45.2154 0.0000 170.0536 28 G 3.0945 7.5143 103.6694 44.7970 0.0000 171.8792 29 Y 4.7041 7.7714 124.3018 55.5598 41.5751 172.2178 30 C 5.3219 9.0198 114.3938 54.1611 37.5952 173.3833 31 N 4.8230 9.5305 122.5010 52.1224 38.7016 178.1341 32 G 3.7634 7.7352 106.2792 48.3970 0.0000 176.1358 33 K 3.9367 7.9956 120.6177 60.0734 33.0283 175.6664 34 G 3.2527 6.5460 104.0360 45.6064 0.0000 172.8145 35 V 4.5011 7.3287 119.8848 60.9801 36.0721 175.7147 36 C 5.0683 8.7298 125.6126 56.2113 39.6752 172.9499 37 V 4.6134 8.4770 119.4554 59.7367 35.0912 174.3442 38 C 5.1394 8.5073 119.4118 55.5395 41.4978 172.7861 39 R 4.8330 8.0945 118.1097 54.6484 35.0543 175.4029 40 N 4.5649 8.5455 116.2920 53.1615 37.4961 174.3525 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 A 8.25 4.28 1.27 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 0.00 0.00 2 T 7.42 4.36 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 1.10 0.00 0.00 3 C 8.00 4.85 0.00 2.94 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 4 D 8.08 4.89 0.00 2.76 1.70 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 5 L 8.66 4.34 0.00 1.59 1.68 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.13 3.94 0.00 1.79 1.76 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 7 S 6.94 4.72 0.00 3.81 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.88 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 0.00 0.00 0.00 9 T 7.64 4.70 4.24 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 1.21 0.00 0.00 10 G 8.17 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 11 I 8.17 3.20 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.09 0.91 0.00 0.00 12 N 7.90 4.11 0.00 2.99 2.73 0.00 0.00 7.07 7.79 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 13 H 8.14 4.41 0.00 3.38 3.56 0.00 5.55 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.30 3.82 0.00 3.99 3.88 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 15 A 8.05 3.96 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 16 C 8.56 4.15 0.00 2.99 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 17 A 8.32 4.36 1.37 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 18 A 8.31 3.86 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 19 H 8.21 3.99 0.00 3.26 3.54 0.00 5.80 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 20 C 8.38 4.14 0.00 3.19 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 21 L 8.06 4.21 0.00 1.90 1.73 0.97 0.45 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 22 L 7.61 4.03 0.00 1.76 1.75 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.30 4.03 0.00 1.77 1.92 0.00 3.17 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 24 G 6.69 3.30 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 0.00 25 N 7.84 5.19 0.00 2.69 2.82 0.00 0.00 6.70 7.62 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 26 R 8.21 4.64 0.00 1.86 1.92 0.00 3.16 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.70 0.00 27 G 8.51 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 28 G 7.51 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 0.00 0.00 0.00 29 Y 7.77 4.70 0.00 3.25 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 30 C 9.02 5.32 0.00 3.17 3.23 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 31 N 9.53 4.82 0.00 3.04 3.18 0.00 0.00 6.62 6.65 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 32 G 7.74 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 0.00 0.00 0.00 33 K 8.00 3.94 0.00 1.74 1.85 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.39 7.81 34 G 6.55 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 0.00 0.00 0.00 35 V 7.33 4.50 2.29 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 0.93 0.00 0.00 0.95 0.00 0.00 36 C 8.73 5.07 0.00 3.02 2.97 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 37 V 8.48 4.61 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 0.93 0.00 0.00 0.61 0.00 0.00 38 C 8.51 5.14 0.00 2.73 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 39 R 8.09 4.83 0.00 1.61 1.79 0.00 3.28 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.71 0.00 40 N 8.55 4.56 0.00 2.75 2.72 0.00 0.00 5.85 7.56 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