NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9012 8.3544 109.7365 45.1471 0.0000 173.8585 2 S 4.2476 7.7516 113.8827 55.8058 64.9183 170.9337 3 S 4.4749 8.5144 119.6117 57.2660 65.5749 175.3691 4 G 3.7839 8.5607 114.8473 46.2945 0.0000 172.7034 5 S 4.3079 8.0669 109.8712 58.8804 66.6043 173.9449 6 S 4.2566 8.0160 115.5091 57.1523 62.1320 174.5381 7 G 4.0101 8.5498 115.1729 46.1003 0.0000 171.0105 8 F 4.7559 8.6557 114.1901 57.0226 40.1248 175.2496 9 V 4.4197 8.0478 119.7462 59.7422 33.0717 174.8017 10 K 4.4512 8.4614 123.2446 55.7255 34.0797 175.2361 11 T 3.4609 8.4787 121.7799 62.2965 67.8697 172.2050 12 V 3.6600 8.2651 122.5296 62.3980 31.6963 177.0207 13 E 4.5217 8.0180 127.9283 52.9257 28.5343 174.9964 14 D 4.3263 7.3170 115.7132 53.6192 44.3132 174.6763 15 K 4.3771 8.0963 122.3846 56.4477 35.8331 173.3977 16 Y 4.8593 8.9503 117.3041 56.5461 41.8024 174.8167 17 K 5.0026 8.3438 119.8789 55.0937 35.6049 174.9999 18 C 4.2025 9.0293 127.9748 59.2742 32.7279 173.3322 19 E 4.1706 7.9026 125.0933 56.4873 28.8269 176.8139 20 K 4.4696 7.6417 118.0561 57.5342 33.8854 176.4430 21 C 4.1992 7.9261 110.6424 57.3896 30.2131 173.6140 22 H 5.0447 8.0477 114.7164 56.0851 26.0047 174.2792 23 L 4.1384 7.2822 120.2283 54.5493 42.3084 176.8085 24 V 4.2617 8.4947 125.3207 63.1119 32.0285 174.9862 25 L 4.9172 9.2319 127.4706 53.4738 45.4683 177.3006 26 C 4.4958 8.8372 116.9964 61.3518 29.1120 174.4972 27 S 4.4247 7.5740 113.2881 55.2090 62.0063 172.4864 28 P 4.5539 0.0000 0.0000 61.7590 33.1442 176.4813 29 K 4.4801 7.2995 112.1030 56.1477 31.9745 176.8426 30 Q 4.3543 8.1477 119.1149 56.1858 29.9009 176.8747 31 T 4.7718 8.4312 119.9974 61.9886 69.4961 174.6209 32 E 4.5823 8.1660 125.5686 56.3066 29.6926 176.8788 33 C 4.6839 8.8304 113.1647 58.4660 31.8098 173.5029 34 G 3.5028 8.9156 111.8033 45.9811 0.0000 173.4571 35 H 4.2588 8.0428 118.1438 55.9430 30.1815 173.7999 36 R 5.0396 8.1707 115.8570 55.1806 34.5955 174.2918 37 F 5.1370 8.5912 118.4003 56.2549 44.3663 173.5710 38 C 4.8383 8.7221 114.2241 56.9400 31.5587 174.4244 39 E 3.9376 8.9597 120.4469 60.2904 29.0582 179.4290 40 S 4.2696 8.6354 114.3227 59.9073 62.4779 176.3523 41 C 3.7469 8.3374 121.3313 63.5105 28.7964 175.5210 42 M 3.8249 8.7123 119.7484 58.9095 31.6283 178.2291 43 A 4.0174 8.0185 119.0600 54.7662 18.8490 179.3542 44 A 4.0173 7.9123 119.6082 55.2742 18.5202 179.5750 45 L 3.8060 7.9002 117.3497 58.1785 41.5639 179.7688 46 L 4.0377 7.5155 117.1415 57.6880 41.4969 178.3757 47 S 4.6260 7.5003 110.9342 58.5472 62.7689 174.5110 48 S 4.5241 7.9111 112.0005 57.4406 62.4007 173.1607 49 S 4.1308 8.1699 117.5959 58.4175 61.9666 170.9917 50 S 4.6927 7.3608 115.8637 56.2291 62.1633 172.0772 51 P 4.2817 0.0000 0.0000 62.6674 31.5349 176.2587 52 K 4.2551 8.8662 121.6188 55.0261 34.7356 175.7285 53 C 5.7227 7.9026 135.0000 59.9804 33.3075 174.7362 54 T 3.7752 7.9446 124.6787 66.5284 67.7570 174.8288 55 A 3.8390 7.8790 122.2948 54.0295 18.6806 177.2924 56 C 4.5036 7.9079 111.6836 56.6628 32.1469 171.6332 57 Q 3.7854 8.6816 121.8374 55.9284 25.0453 171.6364 58 E 4.4707 7.8734 117.9554 55.0267 32.4680 176.0833 59 S 4.7860 7.0021 108.1551 57.9952 65.1956 175.7720 60 I 4.4385 8.7554 129.3088 59.4903 38.6087 175.2662 61 V 4.3441 8.0451 125.2222 60.4204 33.9520 175.7323 62 K 3.7820 9.1014 127.1374 60.2672 32.2835 177.4092 63 D 4.3021 8.0937 117.4345 56.6689 41.1581 176.8360 64 K 4.2864 7.7574 114.8879 56.7681 32.6443 176.8054 65 V 4.5072 7.4987 119.5194 61.8504 32.6739 175.7186 66 F 4.3146 8.4503 122.0081 57.7368 39.5550 174.9942 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 3.90 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 0.00 0.00 0.00 2 S 7.75 4.25 0.00 3.84 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 3 S 8.51 4.47 0.00 3.80 3.64 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 4 G 8.56 3.78 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 0.00 0.00 0.00 5 S 8.07 4.31 0.00 3.73 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 6 S 8.02 4.26 0.00 3.97 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 7 G 8.55 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.66 4.76 0.00 2.90 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 9 V 8.05 4.42 2.12 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 0.86 0.00 0.00 0.94 0.00 0.00 10 K 8.46 4.45 0.00 1.75 1.75 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.41 7.81 11 T 8.48 3.46 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 12 V 8.27 3.66 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 0.72 0.00 0.00 0.96 0.00 0.00 13 E 8.02 4.52 0.00 1.94 1.92 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 2.35 2.20 0.00 14 D 7.32 4.33 0.00 2.47 2.35 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 15 K 8.10 4.38 0.00 1.94 1.73 0.00 1.54 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.45 7.81 16 Y 8.95 4.86 0.00 3.01 2.89 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 17 K 8.34 5.00 0.00 1.73 1.62 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.52 7.81 18 C 9.03 4.20 0.00 3.08 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.90 4.17 0.00 1.16 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 2.08 2.20 0.00 20 K 7.64 4.47 0.00 1.99 1.84 0.00 2.05 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.67 7.81 21 C 7.93 4.20 0.00 3.05 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 22 H 8.05 5.04 0.00 3.32 3.38 0.00 5.77 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.28 4.14 0.00 1.42 1.64 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 24 V 8.49 4.26 2.10 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 0.87 0.00 0.00 0.94 0.00 0.00 25 L 9.23 4.92 0.00 1.60 1.55 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.84 4.50 0.00 3.02 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 27 S 7.57 4.42 0.00 3.77 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 28 P 0.00 4.55 0.00 2.14 2.05 0.00 2.97 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.50 0.00 29 K 7.30 4.48 0.00 1.63 1.81 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.50 7.81 30 Q 8.15 4.35 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 31 T 8.43 4.77 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 32 E 8.17 4.58 0.00 2.04 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 2.32 2.41 0.00 33 C 8.83 4.68 0.00 3.16 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 34 G 8.92 3.50 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 0.00 35 H 8.04 4.26 0.00 3.29 3.25 0.00 5.77 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.17 5.04 0.00 1.70 1.75 0.00 3.26 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.83 0.00 37 F 8.59 5.14 0.00 2.98 2.92 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 38 C 8.72 4.84 0.00 3.14 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 39 E 8.96 3.94 0.00 2.04 2.09 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 2.42 2.46 0.00 40 S 8.64 4.27 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 41 C 8.34 3.75 0.00 3.17 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 42 M 8.71 3.82 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.63 0.00 43 A 8.02 4.02 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 44 A 7.91 4.02 1.32 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 0.00 0.00 45 L 7.90 3.81 0.00 1.47 1.55 -0.03 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.52 4.04 0.00 1.58 1.72 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 47 S 7.50 4.63 0.00 4.00 3.94 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 48 S 7.91 4.52 0.00 3.81 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 49 S 8.17 4.13 0.00 4.03 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.36 4.69 0.00 3.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.28 0.00 2.24 2.33 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.95 0.00 52 K 8.87 4.26 0.00 1.73 1.76 0.00 1.90 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.57 7.81 53 C 7.90 5.72 0.00 3.15 3.12 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 54 T 7.94 3.78 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 55 A 7.88 3.84 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.91 4.50 0.00 3.11 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 57 Q 8.68 3.79 0.00 2.22 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 58 E 7.87 4.47 0.00 1.95 1.91 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 2.23 2.24 0.00 59 S 7.00 4.79 0.00 3.83 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 60 I 8.76 4.44 1.80 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.86 0.00 0.00 61 V 8.05 4.34 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 1.26 0.00 0.00 0.93 0.00 0.00 62 K 9.10 3.78 0.00 1.84 1.93 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.43 7.81 63 D 8.09 4.30 0.00 2.61 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 64 K 7.76 4.29 0.00 1.83 1.93 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.38 7.81 65 V 7.50 4.51 2.30 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 0.86 0.00 0.00 1.05 0.00 0.00 66 F 8.45 4.31 0.00 2.92 2.89 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