NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9897 8.3549 109.7364 45.4549 0.0000 172.6218 2 S 4.5558 8.2955 114.3620 56.6019 66.7408 172.5364 3 S 4.2968 9.0331 120.5486 62.2097 64.2751 173.9735 4 G 4.1286 7.6778 105.2511 43.7405 0.0000 172.8231 5 S 4.7652 8.3665 115.8892 56.0983 65.9524 172.8413 6 S 4.7702 8.4539 114.5873 56.5757 64.3173 173.9805 7 G 4.1901 8.9972 115.8438 43.1299 0.0000 173.3325 8 G 4.6896 7.4932 115.9205 45.5870 0.0000 171.9363 9 T 4.5815 8.1375 115.8641 60.2450 70.7834 174.0142 10 D 4.7007 8.4636 122.2710 51.9676 45.1087 176.2967 11 G 5.1907 8.0331 126.9334 46.7063 0.0000 171.8772 12 T 4.4719 7.3302 109.9592 61.4175 70.2041 176.2266 13 K 3.8108 8.1419 120.4360 57.1909 32.9989 175.6489 14 P 4.8380 0.0000 0.0000 63.0820 30.7428 174.6557 15 E 3.9438 8.1757 123.6854 54.9214 33.4342 175.0270 16 C 4.7510 7.2129 118.9526 56.9669 30.2759 173.9318 17 T 3.9134 8.1967 116.1936 64.7969 67.7027 174.6963 18 L 4.0664 8.0924 121.9859 58.0094 42.5649 177.1276 19 C 4.5266 8.1388 113.4769 58.5160 28.4994 173.9701 20 G 3.9740 8.2732 107.5342 46.4777 0.0000 174.6395 21 V 4.0938 6.8318 119.9098 60.0901 31.2146 172.4434 22 K 3.7784 8.1167 124.1752 56.0224 32.5847 175.5661 23 Y 4.5049 7.0821 125.6098 58.3959 38.7638 176.9955 24 S 4.4358 8.9597 118.1165 57.8811 64.0475 175.5242 25 A 3.9405 8.4838 126.2203 55.4939 18.4405 179.2631 26 R 4.0110 7.7486 115.0446 58.8115 30.4241 176.5918 27 L 4.0395 7.7013 117.9108 55.6178 42.7595 176.3759 28 S 4.6422 7.9477 115.1895 55.5103 68.2289 174.8257 29 I 2.8412 8.1715 123.1143 64.4760 37.4101 178.1690 30 R 4.0308 7.8199 118.0003 59.4975 29.8341 178.2664 31 D 4.3719 8.0711 117.2853 58.6320 41.0769 178.0888 32 H 4.3389 8.2527 119.1933 58.2049 29.6301 176.8890 33 I 3.2679 7.9196 117.8451 63.4999 37.3416 176.4936 34 F 4.5642 8.2308 118.7646 56.3098 40.7772 175.7148 35 S 4.6389 7.9113 114.1207 56.0793 67.2153 175.4147 36 K 3.9989 8.9076 126.1729 59.6405 31.8763 177.7909 37 Q 3.8991 8.0979 118.3087 59.8296 29.2035 178.3226 38 H 4.2442 8.7946 119.0663 59.1775 29.9219 176.8787 39 I 3.6016 7.7466 121.0531 64.6764 36.9221 177.4931 40 S 4.0370 8.5149 113.8903 61.7530 62.1764 176.3109 41 K 3.8098 7.9521 121.7021 59.6761 31.6396 178.8040 42 V 3.8203 7.7709 117.6951 65.4810 31.6934 177.7524 43 R 4.1582 7.7470 117.4222 58.2775 29.9507 178.3212 44 E 3.9935 8.3353 117.8824 59.7762 29.9745 178.5728 45 T 3.9370 7.7068 112.2395 64.3865 67.5113 173.9277 46 V 4.0885 7.5185 117.3048 64.0987 33.1975 175.4541 47 G 4.1695 7.3112 106.3261 43.6291 0.0000 173.3274 48 S 4.4438 8.5530 115.0469 59.3778 63.5241 175.0303 49 Q 3.9226 8.1003 116.5360 56.4318 28.2650 176.8492 50 L 4.2732 8.2613 121.5754 55.1570 41.5252 175.9383 51 D 4.6529 8.2127 118.5353 52.3076 40.1671 176.0959 52 R 3.8123 8.1917 118.4493 59.1674 30.4768 175.9597 53 E 4.5918 7.7975 116.6760 54.4721 31.3141 176.1438 54 K 4.3632 8.3182 122.6518 55.7896 34.2976 176.2139 55 D 4.4526 8.4883 118.8197 54.6710 41.1851 176.0038 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 G 8.35 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 2 S 8.30 4.56 0.00 3.89 3.72 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 3 S 9.03 4.30 0.00 3.85 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 0.00 4 G 7.68 4.13 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 0.00 0.00 0.00 5 S 8.37 4.77 0.00 3.95 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 6 S 8.45 4.77 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 7 G 9.00 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 0.00 0.00 0.00 8 G 7.49 4.69 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 0.00 0.00 0.00 9 T 8.14 4.58 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 D 8.46 4.70 0.00 2.61 2.56 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 0.00 0.00 0.00 0.00 11 G 8.03 5.19 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 0.00 12 T 7.33 4.47 4.26 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 1.22 0.00 0.00 13 K 8.14 3.81 0.00 1.92 1.81 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.41 7.81 14 P 0.00 4.84 0.00 2.41 2.38 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.03 0.00 15 E 8.18 3.94 0.00 1.62 1.69 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 2.04 2.15 0.00 16 C 7.21 4.75 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 3.91 4.21 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 1.21 0.00 0.00 18 L 8.09 4.07 0.00 1.64 1.71 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 19 C 8.14 4.53 0.00 3.12 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 20 G 8.27 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 21 V 6.83 4.09 2.08 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 1.00 0.00 0.00 1.02 0.00 0.00 22 K 8.12 3.78 0.00 1.68 1.66 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.34 7.81 23 Y 7.08 4.50 0.00 3.04 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 24 S 8.96 4.44 0.00 3.93 3.80 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 0.00 0.00 0.00 25 A 8.48 3.94 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 26 R 7.75 4.01 0.00 1.79 1.97 0.00 3.35 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 27 L 7.70 4.04 0.00 1.67 1.90 0.91 0.96 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 28 S 7.95 4.64 0.00 3.76 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.17 2.84 1.83 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.88 0.00 0.00 30 R 7.82 4.03 0.00 1.81 1.89 0.00 3.50 0.00 0.00 3.63 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 31 D 8.07 4.37 0.00 2.71 2.75 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 32 H 8.25 4.34 0.00 2.95 3.08 0.00 5.81 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 33 I 7.92 3.27 1.55 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.67 0.73 0.00 0.00 34 F 8.23 4.56 0.00 3.14 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 35 S 7.91 4.64 0.00 4.05 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.91 4.00 0.00 1.79 1.82 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.50 7.81 37 Q 8.10 3.90 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 38 H 8.79 4.24 0.00 2.84 3.33 0.00 5.88 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 39 I 7.75 3.60 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.37 0.89 0.00 0.00 40 S 8.51 4.04 0.00 3.85 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 41 K 7.95 3.81 0.00 1.90 1.78 0.00 1.56 0.00 0.00 1.57 0.00 0.00 3.18 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.48 7.81 42 V 7.77 3.82 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.87 0.00 0.00 43 R 7.75 4.16 0.00 2.02 1.94 0.00 3.32 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.64 0.00 44 E 8.34 3.99 0.00 1.91 1.98 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 2.49 2.44 0.00 45 T 7.71 3.94 4.35 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 1.24 0.00 0.00 46 V 7.52 4.09 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 0.85 0.00 0.00 0.92 0.00 0.00 47 G 7.31 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.55 4.44 0.00 3.82 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 49 Q 8.10 3.92 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 50 L 8.26 4.27 0.00 1.75 1.72 0.92 0.78 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 51 D 8.21 4.65 0.00 2.80 2.70 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 52 R 8.19 3.81 0.00 1.81 2.01 0.00 3.18 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 53 E 7.80 4.59 0.00 1.94 1.87 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 2.23 2.27 0.00 54 K 8.32 4.36 0.00 1.85 1.80 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 55 D 8.49 4.45 0.00 2.64 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