NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6572 8.4249 119.2044 54.0986 39.5343 174.4486 2 S 4.8045 8.4471 110.9698 57.3684 64.2487 168.8604 3 V 5.1134 7.3750 112.6187 59.8001 35.9273 174.5938 4 R 4.6070 8.3997 117.1217 55.4190 33.0799 173.3380 5 D 5.2881 8.6508 120.5018 52.8912 42.1432 175.5798 6 A 2.7488 6.5247 123.1257 50.7943 22.9547 174.1849 7 Y 4.7236 7.9075 116.6063 57.2612 38.7515 175.9879 8 I 4.2637 8.3894 124.9302 61.0975 38.9462 174.4357 9 A 5.1378 8.5655 128.6532 50.4120 22.7511 175.6609 10 D 4.8230 8.1762 118.7544 52.3322 41.7338 177.1848 11 S 4.3527 8.5301 112.5618 60.2983 63.3790 173.9588 12 H 4.5231 8.5612 118.3810 55.0925 29.1373 174.0654 13 N 4.2530 7.7942 117.4145 55.0931 37.7277 172.7247 14 C 4.8491 7.8992 112.6726 54.4977 43.0155 174.5199 15 V 4.3227 7.9787 117.0048 61.6263 32.6705 175.2388 16 Y 4.4540 8.5675 119.6917 56.5790 38.9207 175.6973 17 E 4.7076 8.8339 124.2993 56.6319 30.5650 175.4122 18 C 4.7303 8.4332 114.0525 54.1264 44.6200 173.5912 19 A 4.6429 8.3861 122.0147 52.0981 20.7936 176.8302 20 R 5.0286 7.5934 113.7528 53.7392 34.2850 176.1335 21 N 4.6385 9.0728 118.5601 56.5226 38.6474 177.4660 22 E 4.0334 8.3178 120.3499 59.2689 29.7444 177.9703 23 Y 4.1422 7.8086 118.4601 60.9627 38.8256 177.6285 24 C 4.0916 8.1946 116.9352 59.7659 40.5600 175.3033 25 N 4.3624 8.2334 118.7439 56.5688 38.4243 176.4673 26 D 4.1678 8.0462 119.3620 57.1797 41.4949 177.6859 27 L 3.6162 7.4031 120.7365 58.3469 42.0376 178.3867 28 C 4.1733 8.3459 116.6687 60.2998 36.6652 176.3668 29 T 4.0228 8.3176 113.1082 63.8891 68.1595 176.3967 30 K 4.1394 8.0998 120.4240 58.6448 32.7031 177.2432 31 N 4.6233 7.1128 115.9129 53.0733 38.5184 175.8445 32 G 3.9054 7.8676 107.7377 44.9104 0.0000 174.3463 33 A 4.6272 7.6392 121.3007 51.1498 19.2543 178.6447 34 K 4.0498 9.0318 121.8552 59.5999 33.0685 176.5645 35 S 4.6392 7.6052 112.3033 58.5885 65.9404 174.2842 36 G 4.3925 8.9098 105.5490 46.2369 0.0000 172.0057 37 Y 5.0595 8.0192 118.1006 55.7768 42.2855 172.5785 38 C 4.6346 9.4512 120.7851 55.6448 45.1494 172.5862 39 Q 4.7188 8.7438 125.9006 54.4626 29.6168 176.3681 40 W 4.5886 9.2525 123.9507 56.9835 29.9773 176.8591 41 V 4.5783 7.0745 117.1782 59.5449 33.8556 174.2762 42 G 3.9747 8.4175 108.8212 45.8033 0.0000 172.1551 43 K 3.6831 8.9585 119.5029 59.2451 31.9388 177.6153 44 Y 4.6234 7.7636 113.1662 57.0994 39.1680 177.7421 45 G 3.8787 8.1270 108.2012 45.3634 0.0000 173.3561 46 N 4.6362 9.1289 120.8185 53.8594 39.4020 175.7929 47 G 4.4346 8.5110 114.4488 46.2639 0.0000 171.1215 48 C 4.9571 8.6826 119.1059 56.3631 42.5918 172.6194 49 W 4.7247 8.7678 133.6806 55.6249 32.9242 173.7907 50 C 5.2921 8.1552 123.8146 55.1045 41.3680 172.7503 51 I 4.6696 8.5827 123.1252 59.8620 38.8607 176.0405 52 E 3.7805 9.2979 128.2434 57.2381 27.5544 174.3734 53 L 4.3273 7.7582 121.1392 54.0641 43.6975 174.9772 54 P 4.8251 0.0000 0.0000 62.4183 32.3277 176.4758 55 D 4.6471 9.1810 121.7705 54.2177 39.8150 177.1410 56 N 4.6544 8.2141 115.2975 53.1184 38.2292 174.6705 57 V 4.3011 7.2184 119.3816 60.4238 33.4815 173.5355 58 P 4.6452 0.0000 0.0000 62.5758 32.5101 175.1272 59 I 5.0463 7.9418 114.6929 58.4897 41.0442 174.7815 60 K 3.9846 8.7964 125.4220 56.5698 32.2646 176.6138 61 V 4.5538 8.0054 119.4454 58.2544 35.0860 173.5169 62 P 4.2111 0.0000 0.0000 63.3380 31.4715 176.0957 63 G 4.0717 8.3822 107.8824 43.0658 0.0000 172.8141 64 K 4.2374 8.0298 119.4264 55.7047 33.9016 176.9045 65 C 4.7054 8.7031 119.7451 55.2010 43.5972 173.0837 66 H 4.5267 8.4500 122.5693 55.6617 28.1086 173.6324 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 N 8.42 4.66 0.00 2.70 2.70 0.00 0.00 6.94 6.75 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 2 S 8.45 4.80 0.00 3.87 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 3 V 7.38 5.11 1.94 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 0.72 0.00 0.00 0.92 0.00 0.00 4 R 8.40 4.61 0.00 1.79 1.94 0.00 2.88 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.67 0.00 5 D 8.65 5.29 0.00 2.71 2.80 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 6 A 6.52 2.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 7.91 4.72 0.00 2.86 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 8 I 8.39 4.26 1.72 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.81 0.80 0.00 0.00 9 A 8.57 5.14 1.17 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 10 D 8.18 4.82 0.00 2.86 2.60 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 11 S 8.53 4.35 0.00 3.90 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 12 H 8.56 4.52 0.00 3.21 3.20 0.00 5.75 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.79 4.25 0.00 2.78 2.83 0.00 0.00 7.00 7.52 0.00 0.00 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 C 7.90 4.85 0.00 2.99 2.76 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 15 V 7.98 4.32 2.20 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 0.31 0.00 0.00 0.90 0.00 0.00 16 Y 8.57 4.45 0.00 3.02 3.10 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 17 E 8.83 4.71 0.00 1.86 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 2.50 2.32 0.00 18 C 8.43 4.73 0.00 2.99 3.17 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 19 A 8.39 4.64 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 20 R 7.59 5.03 0.00 1.97 1.91 0.00 3.22 0.00 0.00 3.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 21 N 9.07 4.64 0.00 2.90 3.02 0.00 0.00 6.66 7.66 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 22 E 8.32 4.03 0.00 2.15 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 0.00 2.43 2.48 0.00 23 Y 7.81 4.14 0.00 3.14 3.17 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 24 C 8.19 4.09 0.00 3.13 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.23 4.36 0.00 2.99 2.82 0.00 0.00 6.85 7.86 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 26 D 8.05 4.17 0.00 2.80 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 27 L 7.40 3.62 0.00 1.20 1.32 0.32 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 28 C 8.35 4.17 0.00 2.88 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 29 T 8.32 4.02 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 1.28 0.00 0.00 30 K 8.10 4.14 0.00 1.86 1.91 0.00 1.47 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.60 1.37 7.81 31 N 7.11 4.62 0.00 2.96 2.77 0.00 0.00 7.24 7.53 0.00 0.00 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 G 7.87 3.91 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 0.00 0.00 0.00 33 A 7.64 4.63 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 34 K 9.03 4.05 0.00 1.74 1.85 0.00 1.85 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.39 7.81 35 S 7.61 4.64 0.00 4.06 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 36 G 8.91 4.39 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 0.00 37 Y 8.02 5.06 0.00 3.30 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 38 C 9.45 4.63 0.00 2.88 2.51 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 0.00 39 Q 8.74 4.72 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.14 0.00 40 W 9.25 4.59 0.00 3.47 3.16 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 41 V 7.07 4.58 2.19 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 0.73 0.00 0.00 0.99 0.00 0.00 42 G 8.42 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 43 K 8.96 3.68 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 1.17 7.81 44 Y 7.76 4.62 0.00 2.07 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 3.88 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 0.00 0.00 0.00 46 N 9.13 4.64 0.00 2.82 2.82 0.00 0.00 6.65 7.98 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 47 G 8.51 4.43 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 0.00 48 C 8.68 4.96 0.00 2.93 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.77 4.72 0.00 2.82 1.90 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 50 C 8.16 5.29 0.00 2.55 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 51 I 8.58 4.67 1.99 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.12 0.97 0.00 0.00 52 E 9.30 3.78 0.00 2.08 1.97 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 2.23 2.37 0.00 53 L 7.76 4.33 0.00 1.62 1.52 0.81 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.83 0.00 2.22 1.92 0.00 3.69 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 55 D 9.18 4.65 0.00 2.70 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 56 N 8.21 4.65 0.00 2.82 2.94 0.00 0.00 5.98 7.68 0.00 0.00 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 V 7.22 4.30 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 0.75 0.00 0.00 0.92 0.00 0.00 58 P 0.00 4.65 0.00 2.27 1.92 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 59 I 7.94 5.05 1.87 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 1.19 0.63 0.80 0.00 0.00 60 K 8.80 3.98 0.00 1.46 1.47 0.00 1.32 0.00 0.00 1.26 0.00 0.00 2.18 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.47 7.81 61 V 8.01 4.55 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 0.86 0.00 0.00 0.91 0.00 0.00 62 P 0.00 4.21 0.00 2.08 2.09 0.00 3.71 0.00 0.00 3.75 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 63 G 8.38 4.07 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 0.00 0.00 0.00 64 K 8.03 4.24 0.00 1.87 1.83 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.47 7.81 65 C 8.70 4.71 0.00 2.83 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 66 H 8.45 4.53 0.00 3.25 3.20 0.00 5.64 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