NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3165 8.1631 117.3743 63.0173 69.9106 173.5261 2 G 3.5036 8.5196 115.4005 45.0882 0.0000 172.0332 3 A 4.2927 8.6698 124.8113 53.4112 21.2631 176.4081 4 G 4.3949 7.4053 109.8598 44.8001 0.0000 175.7292 5 T 3.8864 9.1479 122.2702 66.0856 67.8658 173.3419 6 P 4.3868 0.0000 0.0000 65.0405 31.4992 177.5105 7 S 4.5507 7.7721 113.1325 59.2015 63.6639 175.5183 8 Q 4.2730 7.9634 121.2939 58.0795 28.3192 178.2104 9 G 3.6903 8.1161 108.1389 48.1812 0.0000 174.1888 10 K 4.3239 7.8797 116.5066 56.5784 32.4302 178.0306 11 K 4.3557 7.6340 120.7100 55.3504 30.1207 175.9166 12 N 5.0325 8.0442 114.9510 52.2728 38.5970 175.3125 13 T 4.2983 7.8609 114.8281 63.5210 69.5805 174.0378 14 T 4.5451 8.3196 121.8411 62.0796 69.9566 172.4500 15 T 4.2652 7.6289 114.5288 62.8372 71.3072 173.1247 16 H 4.7934 8.2642 118.9061 55.4185 29.9032 174.9454 17 T 4.8183 9.2986 113.2627 58.9592 72.9131 173.0469 18 K 4.1732 8.8247 122.9728 57.5380 32.7356 175.3548 19 C 4.2196 9.4856 129.1207 58.7655 32.1576 173.9827 20 R 3.6898 8.5738 126.9639 59.5716 29.8862 177.5536 21 R 3.6667 7.3281 116.1832 58.8511 30.1601 176.6625 22 C 4.2805 7.9514 109.6817 57.8328 30.7570 174.6127 23 G 3.8677 8.3083 107.8418 45.3273 0.0000 172.6483 24 E 4.5611 7.7010 118.4844 53.9049 32.0348 175.9030 25 K 4.6897 8.1621 124.8722 55.7530 29.9195 176.4965 26 S 4.7700 7.7991 113.5607 58.0427 66.8475 174.2888 27 Y 4.9054 8.6947 123.7507 56.8946 39.3845 174.2320 28 H 4.4831 8.9950 129.1083 56.1948 30.1229 175.6690 29 T 3.9908 8.6274 122.1213 63.8789 66.9191 174.9731 30 K 4.3179 8.1430 118.7964 57.8473 33.2307 177.4124 31 K 4.1009 7.9444 116.1079 55.7571 32.5855 176.3215 32 K 3.3077 8.2684 118.1671 56.8368 30.0813 175.1894 33 V 4.6136 6.6825 115.9298 61.2259 35.0884 172.8775 34 C 5.0758 9.4601 127.8071 58.4514 32.1950 174.5370 35 S 4.3793 9.2245 122.4131 60.4883 63.2403 175.5197 36 S 4.3838 8.2385 115.5884 60.5039 62.6040 174.2799 37 C 4.4594 8.1178 112.5070 57.3629 30.4097 174.8634 38 G 3.9935 8.3558 108.8291 45.7675 0.0000 173.3116 39 F 4.5452 8.0451 122.3904 59.7222 39.7464 175.6898 40 G 3.9208 8.5783 115.2624 46.0338 0.0000 173.7689 41 K 4.3518 8.1351 119.4837 57.2937 33.4648 176.3356 42 S 4.6988 7.6202 109.7635 56.1607 66.0236 173.6733 43 A 4.1606 8.6908 125.2596 55.1772 18.4492 178.7952 44 K 4.2707 7.1799 112.8995 55.9449 32.8330 177.0707 45 R 4.2735 8.2230 120.9116 55.8998 30.7776 176.5951 46 R 3.8478 8.5979 125.3015 56.7612 30.5681 175.3120 47 D 4.4563 7.3898 122.9607 53.7129 44.2894 174.0860 48 Y 4.5243 8.8465 122.3716 55.8840 41.7577 176.5150 49 E 4.0023 8.6299 122.1030 58.8360 29.7625 178.2831 50 W 4.4957 7.6147 114.6012 57.9619 28.4671 177.3067 51 Q 4.4201 7.4594 117.5030 57.2656 28.1181 175.6370 52 S 4.7110 7.5576 111.5821 56.3165 66.3784 174.1304 53 K 4.0481 8.6310 120.4961 56.3290 32.4560 177.9181 54 A 4.0126 8.9037 126.6034 55.3664 18.2432 178.7012 55 G 4.1302 7.7584 102.4544 45.0591 0.0000 173.2380 56 E 4.2444 8.1326 126.4474 56.3841 29.9603 174.4002 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 T 8.16 4.32 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 2 G 8.52 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 3 A 8.67 4.29 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 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 5 T 9.15 3.89 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 6 P 0.00 4.39 0.00 2.22 2.18 0.00 3.65 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 2.15 2.05 0.00 7 S 7.77 4.55 0.00 4.16 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 8 Q 7.96 4.27 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 9 G 8.12 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 0.00 0.00 0.00 10 K 7.88 4.32 0.00 1.76 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.45 7.81 11 K 7.63 4.36 0.00 1.89 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.48 7.81 12 N 8.04 5.03 0.00 2.77 2.83 0.00 0.00 6.35 7.71 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 13 T 7.86 4.30 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 14 T 8.32 4.55 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 15 T 7.63 4.27 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 16 H 8.26 4.79 0.00 3.09 3.54 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.30 4.82 4.33 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 1.33 0.00 0.00 18 K 8.82 4.17 0.00 1.79 1.82 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.52 7.81 19 C 9.49 4.22 0.00 3.19 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 20 R 8.57 3.69 0.00 1.53 1.45 0.00 3.15 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 21 R 7.33 3.67 0.00 0.67 1.49 0.00 3.30 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.34 0.00 22 C 7.95 4.28 0.00 3.10 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.31 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 0.00 0.00 0.00 24 E 7.70 4.56 0.00 1.94 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 2.33 2.25 0.00 25 K 8.16 4.69 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.52 7.81 26 S 7.80 4.77 0.00 3.87 3.86 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 27 Y 8.69 4.91 0.00 3.15 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 28 H 8.99 4.48 0.00 3.14 2.98 0.00 5.84 0.00 0.00 0.00 0.00 6.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.63 3.99 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 1.18 0.00 0.00 30 K 8.14 4.32 0.00 1.86 1.84 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.42 7.81 31 K 7.94 4.10 0.00 1.53 1.71 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.51 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.18 0.89 7.81 32 K 8.27 3.31 0.00 1.79 1.86 0.00 1.73 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.49 7.81 33 V 6.68 4.61 1.99 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 1.10 0.00 0.00 0.94 0.00 0.00 34 C 9.46 5.08 0.00 3.39 3.14 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 35 S 9.22 4.38 0.00 4.05 4.10 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 36 S 8.24 4.38 0.00 3.91 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 37 C 8.12 4.46 0.00 3.16 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 38 G 8.36 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 39 F 8.05 4.55 0.00 3.08 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 40 G 8.58 3.92 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 0.00 41 K 8.14 4.35 0.00 1.68 2.01 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.36 7.81 42 S 7.62 4.70 0.00 3.96 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 43 A 8.69 4.16 1.33 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 0.00 0.00 44 K 7.18 4.27 0.00 1.76 1.71 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.40 7.81 45 R 8.22 4.27 0.00 1.64 1.82 0.00 3.37 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 46 R 8.60 3.85 0.00 1.91 1.98 0.00 3.46 0.00 0.00 3.43 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 47 D 7.39 4.46 0.00 2.48 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 0.00 0.00 0.00 0.00 48 Y 8.85 4.52 0.00 1.43 1.47 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.63 4.00 0.00 2.00 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 0.00 2.29 2.25 0.00 50 W 7.61 4.50 0.00 3.53 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.46 4.42 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.11 1.53 0.00 52 S 7.56 4.71 0.00 3.92 3.79 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 53 K 8.63 4.05 0.00 1.83 1.80 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.90 4.01 1.33 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 0.00 0.00 55 G 7.76 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 56 E 8.13 4.24 0.00 1.93 1.86 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 2.23 2.24 0.00