NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2936 8.0327 110.9342 61.3198 71.3405 175.2017 3 K 3.8147 8.1511 122.3675 58.2181 32.2387 177.1801 4 G 3.8437 8.3515 105.8912 47.5908 0.0000 174.9395 5 K 3.9489 7.9596 121.1477 59.0687 32.3036 178.7547 6 A 3.4601 7.6363 121.0230 55.1093 18.3221 179.7518 7 T 4.0020 8.3056 109.0001 64.8711 68.6631 177.1592 8 V 3.6079 7.4782 120.9299 64.3686 31.3915 178.2295 9 A 3.8893 7.6569 121.2264 55.0468 18.1802 179.7002 10 F 4.8317 8.0769 117.3575 60.0815 39.0996 177.4457 11 A 4.2967 8.2705 119.2890 53.5404 18.2851 179.4423 12 R 3.8257 7.7471 118.1142 59.5567 30.0691 178.4398 13 E 4.0344 7.9742 118.7284 58.9603 29.4999 179.3118 14 A 4.0096 8.0691 120.8667 55.0304 18.1829 179.6785 15 R 3.8759 7.7401 116.4453 59.6817 29.9556 178.5651 16 T 3.9872 8.3459 110.2147 64.6204 68.7974 176.0440 17 E 3.9244 8.6293 122.6457 59.2232 29.6216 178.9018 18 V 3.7695 7.9497 117.5218 65.1336 31.5384 177.7171 19 R 4.0714 7.8408 118.1649 58.7949 29.6596 178.1108 20 K 3.9644 7.7135 118.9358 58.4545 32.2907 178.0718 21 V 4.2892 7.5908 116.1526 62.0610 32.2140 177.1184 22 I 4.0472 7.5896 120.5391 63.2845 36.8847 177.7406 23 W 4.4061 8.1796 129.9574 58.9927 30.4390 175.5213 24 P 4.6696 0.0000 0.0000 63.0525 31.3423 175.4043 25 T 4.3511 7.5624 112.2110 64.5088 68.7714 174.5733 26 R 4.1498 7.5264 121.8704 54.5956 29.6416 176.3468 27 K 3.8219 7.6377 113.9236 60.6786 31.6582 173.2095 28 P 3.8807 0.0000 0.0000 62.1751 32.0116 178.0714 29 T 3.7529 7.8946 114.8421 64.0789 69.6936 175.6800 30 K 4.7464 7.7900 119.0821 55.9429 33.9957 177.2495 31 D 4.4008 8.2377 122.5818 57.6815 40.3330 177.7313 32 E 3.8790 8.2218 119.3736 59.8586 29.5697 178.1329 33 Y 4.1593 7.8875 118.4937 60.0715 39.1399 176.8948 34 L 3.4364 8.0281 121.6019 57.8042 41.8942 178.7984 35 A 3.9436 7.6733 120.4928 55.0387 18.2284 180.0599 36 V 3.5068 7.4562 117.2506 64.9954 31.7457 178.3885 37 A 3.8549 7.8110 121.9116 54.3911 18.0315 179.5888 38 K 3.8064 8.3567 118.7034 59.7462 32.4088 179.5056 39 V 3.8349 7.5553 119.4057 64.2670 31.4216 178.4894 40 T 3.8056 8.1498 110.9713 64.8773 68.7136 176.4440 41 A 4.0119 7.9071 123.4024 53.8723 18.0620 179.2217 42 L 3.9860 8.3951 120.0371 58.2364 41.9511 179.4703 43 G 3.5945 7.8722 105.2126 47.7907 0.0000 175.9479 44 I 3.7488 8.0138 122.5233 63.8418 36.9652 178.5392 45 S 4.0029 8.0419 114.2226 61.2871 62.2816 175.9751 46 L 3.9448 7.5509 122.4793 58.2401 41.9637 178.9670 47 L 4.1328 7.8173 119.2201 57.6210 41.6118 179.7850 48 G 3.6029 8.1271 105.8439 47.7133 0.0000 175.7709 49 I 3.7205 8.1793 121.6864 63.7775 38.1485 177.8641 50 I 3.8618 8.0991 119.8143 63.9524 37.8048 178.1374 51 G 3.7805 8.1776 106.3003 47.4179 0.0000 175.1603 52 Y 4.0797 7.9156 121.8489 60.5848 38.7058 177.2458 53 I 3.7776 7.8866 118.4875 63.9482 38.3325 177.5309 54 I 3.8416 7.4413 118.2869 64.3431 37.7354 177.4305 55 H 4.1541 7.9424 117.9174 59.7744 30.0565 176.8146 56 V 3.5784 7.9080 121.6530 62.8610 31.0453 176.7000 57 P 4.0710 0.0000 0.0000 64.5818 31.6587 178.2258 58 A 4.1197 8.3549 119.7490 54.2861 17.8745 178.6190 59 T 4.4220 7.9025 106.8387 62.1582 69.3285 176.1774 60 Y 4.0098 7.7973 123.3810 60.9369 39.1183 177.3678 61 I 3.7430 7.7316 119.1614 63.9289 38.0065 177.6920 62 K 4.2091 7.8468 118.6501 58.6307 32.0075 178.1602 63 G 3.7559 7.3887 103.6012 46.5552 0.0000 175.0496 64 I 4.1055 7.1771 118.9186 61.3405 39.4906 176.0910 65 L 4.5881 7.0466 118.9953 53.9278 42.9020 175.1135 66 K 4.2546 7.9951 123.0385 56.2203 32.1365 176.3913 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 2 T 8.03 4.29 4.23 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 1.20 0.00 0.00 3 K 8.15 3.81 0.00 1.94 1.86 0.00 1.78 0.00 0.00 1.87 0.00 0.00 3.15 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.55 1.61 7.81 4 G 8.35 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 5 K 7.96 3.95 0.00 1.78 1.90 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.44 7.81 6 A 7.64 3.46 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.31 4.00 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 1.32 0.00 0.00 8 V 7.48 3.61 2.04 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 0.88 0.00 0.00 0.91 0.00 0.00 9 A 7.66 3.89 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.08 4.83 0.00 3.25 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 11 A 8.27 4.30 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.75 3.83 0.00 1.83 2.09 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 1.63 1.67 0.00 13 E 7.97 4.03 0.00 2.51 2.01 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 2.39 2.26 0.00 14 A 8.07 4.01 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 15 R 7.74 3.88 0.00 1.91 2.23 0.00 3.44 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 16 T 8.35 3.99 4.20 0.00 0.00 0.00 0.00 0.00 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 17 E 8.63 3.92 0.00 2.21 2.17 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 2.30 2.36 0.00 18 V 7.95 3.77 2.26 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 0.96 0.00 0.00 0.96 0.00 0.00 19 R 7.84 4.07 0.00 1.96 2.04 0.00 3.14 0.00 0.00 3.04 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 20 K 7.71 3.96 0.00 1.74 1.94 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.29 7.81 21 V 7.59 4.29 2.11 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 0.99 0.00 0.00 0.96 0.00 0.00 22 I 7.59 4.05 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.24 0.99 0.00 0.00 23 W 8.18 4.41 0.00 3.46 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.67 0.00 2.22 2.17 0.00 3.99 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 25 T 7.56 4.35 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 1.22 0.00 0.00 26 R 7.53 4.15 0.00 1.82 2.26 0.00 3.32 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 27 K 7.64 3.82 0.00 2.13 1.90 0.00 1.26 0.00 0.00 0.79 0.00 0.00 2.80 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.18 1.33 7.81 28 P 0.00 3.88 0.00 2.31 1.95 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 29 T 7.89 3.75 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 1.15 0.00 0.00 30 K 7.79 4.75 0.00 2.21 2.12 0.00 1.61 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.50 7.81 31 D 8.24 4.40 0.00 2.82 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.22 3.88 0.00 2.11 2.11 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 2.44 2.41 0.00 33 Y 7.89 4.16 0.00 3.09 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 34 L 8.03 3.44 0.00 1.72 1.56 0.76 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 35 A 7.67 3.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.46 3.51 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 0.92 0.00 0.00 0.94 0.00 0.00 37 A 7.81 3.85 1.09 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 38 K 8.36 3.81 0.00 1.81 1.75 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.40 7.81 39 V 7.56 3.83 2.05 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 0.83 0.00 0.00 0.91 0.00 0.00 40 T 8.15 3.81 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 1.26 0.00 0.00 41 A 7.91 4.01 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 42 L 8.40 3.99 0.00 1.90 1.76 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.87 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 0.00 0.00 0.00 44 I 8.01 3.75 1.86 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 1.41 0.71 0.91 0.00 0.00 45 S 8.04 4.00 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.55 3.94 0.00 1.80 1.64 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.82 4.13 0.00 1.73 1.71 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.13 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.18 3.72 1.89 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 1.38 1.16 0.98 0.00 0.00 50 I 8.10 3.86 1.96 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 1.48 1.20 1.02 0.00 0.00 51 G 8.18 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 52 Y 7.92 4.08 0.00 3.15 3.08 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 53 I 7.89 3.78 1.98 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 1.43 0.98 1.03 0.00 0.00 54 I 7.44 3.84 1.88 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 1.39 1.17 1.07 0.00 0.00 55 H 7.94 4.15 0.00 3.39 3.22 0.00 5.81 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.91 3.58 1.72 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 -0.34 0.00 0.00 0.69 0.00 0.00 57 P 0.00 4.07 0.00 2.13 2.06 0.00 3.52 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 58 A 8.35 4.12 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 59 T 7.90 4.42 4.27 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 1.26 0.00 0.00 60 Y 7.80 4.01 0.00 3.00 3.08 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 61 I 7.73 3.74 1.91 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 1.41 1.19 1.02 0.00 0.00 62 K 7.85 4.21 0.00 1.85 1.87 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.44 7.81 63 G 7.39 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 64 I 7.18 4.11 1.85 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 1.35 0.78 0.93 0.00 0.00 65 L 7.05 4.59 0.00 1.63 1.48 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.00 4.25 0.00 1.73 1.66 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.42 7.81