NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8535 8.1976 109.7375 45.9305 0.0000 174.7404 4 I 2.9796 8.3851 123.6951 60.7376 37.9646 172.6362 5 R 4.2182 9.7042 124.5786 55.6247 31.1727 177.4903 6 E 4.3885 8.6007 126.7203 55.6555 31.5601 176.6071 7 K 4.7428 8.5109 122.0838 55.7469 32.1330 176.9175 8 I 4.2313 8.6436 127.2997 60.8600 38.9967 175.5132 9 K 4.7306 8.2374 121.6337 55.5472 34.6024 175.9404 10 L 4.7730 8.9103 125.8496 54.1072 43.6942 176.1437 11 V 4.8148 8.9114 122.6066 60.7744 34.5141 174.5928 12 S 2.9012 8.7408 123.1111 58.7957 61.9452 174.5949 13 S 4.2589 8.0399 121.6793 61.0264 63.5029 174.6541 14 A 4.1431 7.8901 122.1855 51.4859 18.8184 177.2363 15 G 3.7881 8.7818 108.4516 48.9029 0.0000 174.5313 16 T 3.8159 7.6367 108.1552 61.5134 69.1295 173.0383 17 G 4.0771 8.4949 111.8501 46.1925 0.0000 173.0807 18 H 4.7733 8.2467 120.2439 55.6744 31.3986 174.1488 19 F 5.7376 7.2308 116.9311 56.9501 40.6572 173.5899 20 Y 4.1597 9.0096 120.7885 58.1102 39.8828 174.1343 21 T 4.9045 8.0230 113.9650 62.0378 70.4942 172.6375 22 T 4.5124 8.0883 122.4627 62.1697 71.9709 171.3703 23 T 5.4432 8.6746 109.9131 60.2960 72.1525 172.7872 24 K 4.6300 8.7705 120.5024 55.3973 36.9875 175.3133 25 N 4.8044 8.7093 119.4150 52.0945 37.7816 173.8831 26 K 3.8800 8.7288 127.6104 59.5428 31.9198 177.3440 27 R 4.1047 7.6844 118.6482 58.3993 30.3976 177.6037 28 T 4.0738 7.8966 110.5531 63.3986 69.6619 175.2914 29 K 4.7970 7.7136 121.0838 55.0693 33.2326 174.6381 30 P 4.4952 0.0000 0.0000 65.0223 32.2882 177.8226 31 E 3.9888 7.9635 117.2481 55.5277 30.0089 176.3795 32 K 4.3653 8.8312 121.5942 55.7620 31.8993 176.6545 33 L 4.1619 8.4475 125.4375 55.6172 41.0200 176.2494 34 E 5.1392 8.1030 121.9387 54.5251 32.9836 174.9171 35 L 4.4650 8.2552 120.1761 55.2732 44.1825 173.3688 36 K 4.9321 8.7830 119.8398 56.5486 33.1814 176.3514 37 K 4.4417 8.8699 122.2056 54.8907 37.4914 174.5973 38 F 4.9003 8.3826 123.9172 57.8750 40.2332 174.2358 39 D 4.7292 9.2947 127.4905 51.4871 40.9876 175.2907 40 P 3.8178 0.0000 0.0000 65.2348 31.7534 178.9541 41 V 3.6592 7.6331 111.2623 63.0279 31.7299 176.7272 42 V 4.0604 7.6723 117.0100 61.9810 31.9415 175.3771 43 R 3.7303 7.1993 115.9820 57.2181 28.3245 175.0598 44 Q 4.9801 7.5580 114.7478 55.3260 34.5176 174.1866 45 H 5.3468 8.9500 117.9398 55.1521 29.8432 175.1267 46 V 4.6325 8.7169 122.3669 60.7044 36.0165 174.2284 47 I 4.3138 8.2626 124.2774 61.4972 38.0217 174.6292 48 Y 4.8211 9.0576 125.2322 56.5557 40.2239 174.9963 49 K 4.7863 8.1759 124.5477 55.5276 36.2366 170.6547 50 E 4.0113 9.0304 125.8340 55.2983 31.1481 174.8563 51 A 5.1842 8.6743 134.0612 53.5055 20.5827 176.5831 52 K 4.1635 7.7094 125.0489 56.6046 32.8896 175.9841 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 3 G 8.20 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.39 2.98 1.87 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 1.30 0.64 0.91 0.00 0.00 5 R 9.70 4.22 0.00 1.69 1.90 0.00 3.26 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 6 E 8.60 4.39 0.00 1.92 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 2.31 2.41 0.00 7 K 8.51 4.74 0.00 1.66 1.82 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 8 I 8.64 4.23 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.09 0.96 0.00 0.00 9 K 8.24 4.73 0.00 1.65 1.75 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.29 7.81 10 L 8.91 4.77 0.00 1.87 1.86 0.91 0.68 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 11 V 8.91 4.81 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 0.96 0.00 0.00 1.01 0.00 0.00 12 S 8.74 2.90 0.00 3.80 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 13 S 8.04 4.26 0.00 3.82 4.17 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 14 A 7.89 4.14 1.20 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 0.00 0.00 0.00 15 G 8.78 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 0.00 0.00 0.00 16 T 7.64 3.82 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 17 G 8.49 4.08 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 0.00 0.00 0.00 18 H 8.25 4.77 0.00 3.25 3.40 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.23 5.74 0.00 3.51 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 20 Y 9.01 4.16 0.00 2.74 2.90 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 21 T 8.02 4.90 4.45 0.00 0.00 0.00 0.00 0.00 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 22 T 8.09 4.51 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 23 T 8.67 5.44 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 1.26 0.00 0.00 24 K 8.77 4.63 0.00 1.81 1.91 0.00 1.31 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.32 1.38 7.81 25 N 8.71 4.80 0.00 2.71 2.81 0.00 0.00 6.88 6.68 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 26 K 8.73 3.88 0.00 1.73 1.87 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.56 7.81 27 R 7.68 4.10 0.00 2.10 1.80 0.00 3.18 0.00 0.00 3.22 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 28 T 7.90 4.07 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 29 K 7.71 4.80 0.00 1.89 1.75 0.00 1.96 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.37 1.52 7.81 30 P 0.00 4.50 0.00 2.18 2.18 0.00 3.77 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 31 E 7.96 3.99 0.00 2.10 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 2.28 2.28 0.00 32 K 8.83 4.37 0.00 1.78 1.85 0.00 1.80 0.00 0.00 0.61 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.40 7.81 33 L 8.45 4.16 0.00 1.75 1.70 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.10 5.14 0.00 1.85 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 2.22 2.47 0.00 35 L 8.26 4.46 0.00 1.68 1.72 0.91 0.64 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 36 K 8.78 4.93 0.00 1.73 1.89 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.52 7.81 37 K 8.87 4.44 0.00 0.79 0.74 0.00 1.22 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 1.09 7.81 38 F 8.38 4.90 0.00 2.76 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 39 D 9.29 4.73 0.00 2.80 2.52 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 0.00 0.00 0.00 0.00 40 P 0.00 3.82 0.00 2.15 2.19 0.00 3.14 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.72 0.00 41 V 7.63 3.66 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 0.65 0.00 0.00 0.94 0.00 0.00 42 V 7.67 4.06 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 0.76 0.00 0.00 0.90 0.00 0.00 43 R 7.20 3.73 0.00 2.01 2.20 0.00 3.31 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 44 Q 7.56 4.98 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 45 H 8.95 5.35 0.00 3.10 3.35 0.00 5.84 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.72 4.63 1.98 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 0.94 0.00 0.00 0.94 0.00 0.00 47 I 8.26 4.31 1.87 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 1.36 1.14 0.94 0.00 0.00 48 Y 9.06 4.82 0.00 3.04 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 K 8.18 4.79 0.00 1.84 1.66 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.49 7.81 50 E 9.03 4.01 0.00 2.13 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 0.00 2.14 2.65 0.00 51 A 8.67 5.18 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 52 K 7.71 4.16 0.00 1.99 1.78 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.51 7.81