NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.0550 0.0000 0.0000 62.5711 33.7471 174.1724 3 M 4.6706 7.7412 119.4650 53.7006 33.9357 174.9680 4 F 4.9633 9.2256 120.7489 55.8079 44.7050 172.7333 5 E 5.2213 9.3098 121.2410 54.1963 32.6400 174.8900 6 A 4.7101 9.1695 128.6472 52.2439 19.1126 177.8039 7 A 4.3989 9.3723 124.2222 52.5852 19.9496 176.3758 8 Y 4.6073 7.4553 111.0251 55.8813 42.2275 174.7846 9 D 4.6566 8.6508 121.0722 54.7581 42.0246 176.5689 10 F 5.2412 9.5025 124.7627 55.7436 39.9419 173.2659 11 P 3.9494 0.0000 0.0000 63.0999 31.8318 178.3271 12 G 3.3016 7.2123 106.4847 44.3764 0.0000 172.2812 13 S 4.5297 9.3916 111.6776 57.6159 64.0950 174.9950 14 G 3.9801 8.3053 109.1046 45.1896 0.0000 174.0277 15 S 4.1687 7.8338 115.1401 57.7701 62.7286 173.2240 16 P 4.4579 0.0000 0.0000 64.9655 31.4832 177.1378 17 S 4.5118 8.1218 114.8987 59.4176 63.2707 173.4263 18 E 5.1320 7.7912 119.7055 55.0874 31.3470 175.9932 19 L 4.6935 8.7917 124.5667 52.5269 42.9449 174.0490 20 P 4.6406 0.0000 0.0000 62.7173 32.2208 175.8908 21 L 5.1357 9.2569 122.8062 53.0376 46.0401 175.5796 22 K 4.9900 9.2489 121.7374 54.1273 34.7283 176.0646 23 K 3.9975 9.1172 125.1497 58.6267 32.3940 176.8655 24 G 4.0419 9.0282 114.9892 45.1315 0.0000 173.5726 25 D 4.4779 8.1623 120.6375 54.7089 41.8317 175.6220 26 V 4.8155 8.3604 123.3680 61.6195 33.0348 174.7982 27 I 4.8765 8.8788 120.2362 59.6327 41.8686 173.0281 28 Y 4.7976 9.1057 125.2254 56.6033 39.9966 174.1733 29 I 4.7936 8.5452 129.0122 60.6421 37.8370 175.8270 30 T 4.6481 9.0352 116.9751 62.3919 70.8063 174.9699 31 R 4.8217 7.6505 119.5788 54.5527 35.0331 173.6541 32 E 5.1527 8.8372 122.3671 54.6563 32.5285 174.3111 33 E 4.9242 9.3184 126.4784 53.8861 32.3185 175.6715 34 P 4.3853 0.0000 0.0000 64.7458 31.5565 177.7403 35 S 4.1577 7.9310 112.1571 59.6931 63.1675 175.0441 36 G 3.7828 8.6114 110.4127 44.6436 0.0000 172.5777 37 W 5.2574 7.8440 117.9333 54.8728 32.2696 175.0900 38 S 5.3756 9.5644 118.5045 56.7913 66.5631 172.6995 39 L 4.1068 8.7742 126.0597 53.4882 43.3654 175.6163 40 G 4.6643 8.9508 112.9601 44.2269 0.0000 171.1672 41 K 5.2697 9.2909 118.4925 53.2281 35.1314 176.1909 42 L 4.3336 8.7432 125.6225 55.7255 40.6911 178.0453 43 L 4.2516 8.5075 121.0755 56.6068 41.6322 177.6314 44 D 4.4304 7.6045 116.8542 54.2673 39.6590 177.1660 45 G 3.9657 8.2223 108.5738 45.4261 0.0000 174.0637 46 S 4.1703 7.8660 112.8419 59.1856 63.8437 174.3488 47 K 4.3993 7.2842 116.0366 54.1599 29.7180 173.3310 48 E 4.8123 8.2857 125.1866 54.2934 32.8278 174.8811 49 G 3.9591 8.1423 110.7951 46.1999 0.0000 171.5524 50 W 5.3750 8.5854 119.8482 55.9154 30.8989 176.6645 51 V 4.7394 9.2154 115.9261 58.6937 36.3090 173.3907 52 P 3.7337 0.0000 0.0000 62.4131 31.6833 177.7351 53 T 3.6091 8.5029 120.9499 66.5537 68.6136 176.1946 54 A 3.9015 7.6046 122.7878 55.1063 18.4848 177.5347 55 Y 4.7663 7.7996 111.5306 58.7696 38.4938 174.6103 56 M 4.9908 7.8974 121.3850 53.9947 32.8488 175.7180 57 K 4.8408 9.0783 123.9282 54.0384 35.6887 173.8817 58 P 4.3760 0.0000 0.0000 63.8057 32.0284 175.5743 59 H 4.4184 8.1629 122.3018 56.4276 29.8047 172.7818 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 P 0.00 4.06 0.00 1.52 1.82 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 3 M 7.74 4.67 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.67 0.00 4 F 9.23 4.96 0.00 2.98 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 5 E 9.31 5.22 0.00 2.07 1.85 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 2.23 2.40 0.00 6 A 9.17 4.71 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 7 A 9.37 4.40 1.24 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 0.00 0.00 0.00 8 Y 7.46 4.61 0.00 1.43 2.16 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.65 4.66 0.00 2.62 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 9.50 5.24 0.00 3.35 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 11 P 0.00 3.95 0.00 2.14 2.13 0.00 3.97 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 12 G 7.21 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 13 S 9.39 4.53 0.00 3.92 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 14 G 8.31 3.98 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 0.00 0.00 0.00 15 S 7.83 4.17 0.00 3.89 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 16 P 0.00 4.46 0.00 2.23 2.17 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 17 S 8.12 4.51 0.00 3.89 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 18 E 7.79 5.13 0.00 2.12 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 0.00 2.52 2.26 0.00 19 L 8.79 4.69 0.00 1.78 1.75 0.98 0.97 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 20 P 0.00 4.64 0.00 1.99 2.03 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 21 L 9.26 5.14 0.00 1.79 1.65 1.10 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 22 K 9.25 4.99 0.00 1.68 1.72 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.53 7.81 23 K 9.12 4.00 0.00 1.62 1.72 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 24 G 9.03 4.04 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 0.00 0.00 0.00 25 D 8.16 4.48 0.00 2.73 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.36 4.82 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.78 0.00 0.00 27 I 8.88 4.88 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.80 1.00 0.00 0.00 28 Y 9.11 4.80 0.00 3.17 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 29 I 8.55 4.79 2.05 0.00 0.00 0.83 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 0.78 0.95 0.00 0.00 30 T 9.04 4.65 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 1.40 0.00 0.00 31 R 7.65 4.82 0.00 1.72 1.91 0.00 3.09 0.00 0.00 3.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 32 E 8.84 5.15 0.00 1.92 1.81 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 2.19 2.30 0.00 33 E 9.32 4.92 0.00 2.06 1.82 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 2.65 2.47 0.00 34 P 0.00 4.39 0.00 2.03 2.11 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 35 S 7.93 4.16 0.00 4.10 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 36 G 8.61 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 37 W 7.84 5.26 0.00 3.18 3.32 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 38 S 9.56 5.38 0.00 3.65 3.65 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 0.00 0.00 0.00 0.00 39 L 8.77 4.11 0.00 0.27 0.93 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.95 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.29 5.27 0.00 1.76 1.89 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.37 7.81 42 L 8.74 4.33 0.00 1.88 1.91 0.96 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.51 4.25 0.00 1.68 1.79 0.95 1.18 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 44 D 7.60 4.43 0.00 2.83 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 45 G 8.22 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 46 S 7.87 4.17 0.00 3.98 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 47 K 7.28 4.40 0.00 1.89 2.06 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.42 7.81 48 E 8.29 4.81 0.00 1.89 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.27 0.00 49 G 8.14 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.59 5.38 0.00 3.21 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.22 4.74 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 0.91 0.00 0.00 1.01 0.00 0.00 52 P 0.00 3.73 0.00 0.82 0.80 0.00 2.78 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.68 0.00 53 T 8.50 3.61 4.09 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 1.05 0.00 0.00 54 A 7.60 3.90 0.97 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 55 Y 7.80 4.77 0.00 3.11 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 56 M 7.90 4.99 0.00 1.12 1.64 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.58 0.00 57 K 9.08 4.84 0.00 1.86 1.97 0.00 1.36 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.45 7.81 58 P 0.00 4.38 0.00 1.96 2.03 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 59 H 8.16 4.42 0.00 3.11 3.02 0.00 5.98 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00