NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.0891 8.4293 121.4446 55.9136 31.2879 176.5673 20 I 3.9411 7.4697 108.9341 60.2385 38.8351 173.5758 21 D 4.6481 7.3319 119.3938 52.7122 44.8890 175.1858 22 Y 4.5835 8.1724 122.3480 57.4976 37.9825 176.4127 23 K 4.4410 7.5868 119.7618 57.5230 34.9747 177.1201 24 D 4.7029 7.7812 120.6659 53.1264 39.8927 177.6120 25 I 3.6280 7.7602 113.7967 63.4897 37.7833 177.4513 26 A 4.4031 7.8818 121.9193 53.5815 19.4470 178.4277 27 T 4.5334 9.8276 112.3522 65.5170 69.1762 177.1399 28 L 4.1895 7.8635 120.7813 57.4122 41.5482 179.0643 29 K 4.1814 7.6003 116.0212 58.9323 32.5806 177.9999 30 N 4.6341 7.8522 116.3237 54.3000 38.6420 174.6378 31 Y 4.7706 8.2536 117.5217 57.1319 39.9972 174.5952 32 I 5.0831 7.5054 111.9396 58.9228 40.8453 174.8944 33 T 4.1706 8.7675 117.2866 61.5860 68.1686 174.9468 34 E 3.9880 8.6911 121.9480 59.5192 29.4231 178.4905 35 S 4.3788 8.2906 111.7055 58.1477 62.7653 175.7292 36 G 3.9668 8.0133 107.5907 46.1517 0.0000 174.6078 37 K 4.2431 7.5220 120.3220 55.9673 33.1991 176.7614 38 I 4.0845 8.4071 125.3448 61.6623 37.8388 175.4698 39 V 4.2889 8.3697 127.2276 60.7008 32.4833 174.1917 40 P 4.5263 0.0000 0.0000 62.9987 31.9438 177.2619 41 S 4.3112 8.6004 114.9080 61.1453 62.6274 176.6956 42 R 3.7808 8.1311 117.8514 59.0535 28.7133 177.1460 43 I 4.2419 7.5199 117.7650 63.2402 38.7597 177.4493 44 T 3.9460 7.9979 110.7191 62.9151 68.5556 175.5462 45 G 3.8891 8.6661 108.3607 45.6464 0.0000 173.7234 46 T 4.0058 7.5847 114.0852 62.0174 66.7866 174.5207 47 R 4.1107 8.3004 123.1275 56.4091 31.4020 176.5808 48 A 4.2391 8.5000 119.5182 55.1466 19.7073 179.8919 49 K 3.9549 7.9810 116.1680 59.6455 31.9371 178.6147 50 Y 4.0722 8.0967 116.7988 61.1296 37.9065 177.4041 51 Q 4.0291 7.6448 120.5218 59.5973 28.8894 179.2443 52 R 3.8980 7.4897 116.7826 59.5487 30.2236 178.8452 53 Q 3.9431 7.7487 117.5792 59.4671 28.5813 178.4128 54 L 3.7021 8.9730 121.6781 58.0795 41.8981 178.5702 55 A 3.9644 8.4975 120.1399 55.2980 18.4960 179.2582 56 R 3.8247 8.2963 117.1558 60.0170 30.0177 178.5780 57 A 4.1877 8.0897 119.9484 55.2536 18.1371 178.9104 58 I 3.6463 7.9091 118.4593 64.4093 37.3154 178.0660 59 K 3.8447 9.0095 118.9544 60.3239 31.7568 179.7509 60 R 3.7985 8.3134 118.0224 59.3127 30.3988 178.2679 61 A 3.8750 8.2751 120.9863 55.1638 18.3071 179.5301 62 R 3.7462 7.9173 118.3087 58.9069 29.8597 178.4939 63 Y 4.5599 7.1879 114.6003 58.8977 38.3307 176.8713 64 L 4.5466 8.1093 120.2996 53.2947 41.7668 176.3527 65 S 3.7050 7.8831 111.9730 59.2329 61.3023 173.0878 66 L 4.3387 7.3736 116.5623 55.4402 41.9115 176.9831 67 L 4.6381 7.1155 117.4743 52.4613 45.7042 173.4103 68 P 4.3748 0.0000 0.0000 62.7140 32.1073 176.0182 69 Y 4.2085 8.2507 119.2441 60.5975 38.6425 176.1776 70 T 4.3189 7.7600 113.4975 61.8247 68.3314 173.5176 71 D 4.8650 8.4356 123.3485 53.3895 39.6995 177.5283 72 R 4.1728 7.9104 121.0365 58.4288 30.7622 176.3970 73 H 4.6168 7.9989 118.4857 55.8606 28.9315 174.7177 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 19 E 8.43 4.09 0.00 1.74 1.89 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 1.79 2.03 0.00 20 I 7.47 3.94 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.56 0.77 0.00 0.00 21 D 7.33 4.65 0.00 2.46 2.34 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 22 Y 8.17 4.58 0.00 3.18 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 23 K 7.59 4.44 0.00 1.47 1.67 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.72 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 0.38 7.81 24 D 7.78 4.70 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.76 3.63 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 0.98 0.00 0.00 26 A 7.88 4.40 1.30 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 27 T 9.83 4.53 4.36 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 1.33 0.00 0.00 28 L 7.86 4.19 0.00 1.76 1.75 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.60 4.18 0.00 1.99 1.96 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.62 1.49 7.81 30 N 7.85 4.63 0.00 3.02 2.53 0.00 0.00 6.72 7.43 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 31 Y 8.25 4.77 0.00 3.16 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 32 I 7.51 5.08 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.67 1.01 0.00 0.00 33 T 8.77 4.17 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 1.24 0.00 0.00 34 E 8.69 3.99 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 35 S 8.29 4.38 0.00 4.10 4.08 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 0.00 0.00 0.00 0.00 36 G 8.01 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 0.00 0.00 0.00 37 K 7.52 4.24 0.00 1.73 1.76 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.44 7.81 38 I 8.41 4.08 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.96 0.00 0.00 39 V 8.37 4.29 2.15 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 0.78 0.00 0.00 1.03 0.00 0.00 40 P 0.00 4.53 0.00 2.28 2.20 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 41 S 8.60 4.31 0.00 3.92 4.19 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 42 R 8.13 3.78 0.00 1.97 2.12 0.00 3.02 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 43 I 7.52 4.24 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.91 0.90 0.00 0.00 44 T 8.00 3.95 4.30 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 1.43 0.00 0.00 45 G 8.67 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 46 T 7.58 4.01 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 1.38 0.00 0.00 47 R 8.30 4.11 0.00 1.67 1.73 0.00 3.25 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.14 0.00 48 A 8.50 4.24 1.30 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 49 K 7.98 3.95 0.00 1.91 2.02 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.62 1.59 7.81 50 Y 8.10 4.07 0.00 2.95 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 51 Q 7.64 4.03 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 52 R 7.49 3.90 0.00 2.09 1.97 0.00 3.22 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 53 Q 7.75 3.94 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 54 L 8.97 3.70 0.00 1.58 1.59 0.50 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.50 3.96 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 56 R 8.30 3.82 0.00 1.96 2.08 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 57 A 8.09 4.19 1.43 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 0.00 0.00 0.00 58 I 7.91 3.65 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.88 0.00 0.00 59 K 9.01 3.84 0.00 1.90 2.17 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.71 7.81 60 R 8.31 3.80 0.00 2.22 2.07 0.00 3.08 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.55 0.00 61 A 8.28 3.87 1.50 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 0.00 0.00 62 R 7.92 3.75 0.00 1.33 0.66 0.00 2.94 0.00 0.00 2.75 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.47 0.00 63 Y 7.19 4.56 0.00 2.93 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 64 L 8.11 4.55 0.00 1.82 1.69 0.79 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.88 3.71 0.00 3.97 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 66 L 7.37 4.34 0.00 1.91 1.72 1.06 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.12 4.64 0.00 1.49 1.35 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.37 0.00 2.04 2.02 0.00 3.60 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 69 Y 8.25 4.21 0.00 3.01 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 70 T 7.76 4.32 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 71 D 8.44 4.86 0.00 2.79 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 72 R 7.91 4.17 0.00 1.64 1.91 0.00 3.29 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 73 H 8.00 4.62 0.00 3.17 3.18 0.00 5.73 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