NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4433 8.1633 120.3268 54.4778 33.6203 177.2856 2 K 3.5183 8.1004 115.9096 60.1709 32.2885 176.2236 3 A 4.1339 8.4812 127.7951 54.7297 20.5703 179.6472 4 K 3.9017 8.2801 116.5277 59.8533 32.1336 177.6638 5 E 4.1300 7.7984 117.1356 58.7962 29.7241 177.6898 6 L 4.0716 8.0902 119.2100 55.7769 42.4885 177.9964 7 R 4.1593 8.7463 120.7256 56.8194 29.9085 177.9581 8 E 4.0179 7.6586 116.0440 57.1570 29.8753 174.6003 9 K 3.8152 7.5693 123.3750 55.2294 32.8594 176.1554 10 S 4.0641 8.6968 117.4312 62.0015 62.3472 176.8925 11 V 3.5447 7.8101 120.5821 65.7276 31.2310 177.3304 12 E 4.4381 7.7074 116.0722 57.4079 29.7344 178.7179 13 E 4.1452 8.0961 120.8949 58.7583 29.5921 178.6408 14 L 3.9449 8.0345 118.8342 58.2262 41.4002 179.4679 15 N 4.4217 8.1415 115.8364 56.7423 37.2780 176.0402 16 T 3.9251 7.9759 118.6437 66.5019 68.4139 175.8646 17 E 4.6041 8.0192 120.9108 58.8021 29.7070 178.8171 18 L 3.9095 7.8839 121.4333 58.3801 40.7090 178.9145 19 L 4.0130 7.8924 118.5189 58.0841 41.5828 178.9103 20 N 4.9909 7.6648 116.6613 56.5032 38.5349 177.0544 21 L 4.2623 8.2941 120.1648 56.0512 41.6770 176.0307 22 L 3.8855 8.0866 128.1846 56.1413 42.1164 176.9703 23 R 4.5718 8.9218 129.4908 57.5694 28.4688 178.2033 24 E 4.2641 7.4818 117.3440 59.8343 29.2996 178.8134 25 Q 4.0473 8.4035 118.3939 59.2259 29.4879 176.9062 26 F 4.1065 8.4898 121.9562 60.8177 38.8494 176.3755 27 N 4.1575 9.9466 116.7062 57.1076 38.4909 177.5876 28 L 3.8865 7.2545 117.8946 58.1763 41.9366 179.4077 29 R 3.8922 7.9389 117.7546 59.7740 29.9347 178.7460 30 M 3.8836 7.5783 117.2765 58.6909 32.2638 178.5480 31 Q 4.2949 9.3547 121.3904 57.7932 28.8293 177.6462 32 A 4.6630 8.1689 121.3829 52.3178 20.3633 178.0452 33 A 4.2178 7.7976 116.9967 53.4873 18.7406 177.9462 34 S 4.6887 7.8989 113.1622 57.9479 65.2405 176.3511 35 G 3.8157 8.2870 115.7234 46.0687 0.0000 179.5999 36 Q 2.8009 10.0254 123.2224 56.5877 29.0970 175.9164 37 L 3.8945 5.6200 132.6783 55.4584 41.1186 175.3686 38 Q 4.7312 8.5517 126.6101 56.2262 29.5322 176.2997 39 Q 4.7090 7.7004 116.7321 54.6124 29.1886 176.2002 40 S 4.1033 8.3179 117.8626 61.7993 63.6488 176.1454 41 H 4.0150 8.5649 119.0866 58.3073 27.4818 176.8822 42 L 3.7918 7.2837 120.3120 57.8050 41.6009 178.8331 43 L 4.0845 7.8665 117.1942 58.0214 40.4816 178.8784 44 K 3.9194 8.2461 119.4572 61.3415 32.2171 178.7492 45 Q 4.2967 8.6960 118.8963 56.4006 31.4551 175.2494 46 V 3.7329 8.5155 123.9547 65.3997 31.3713 175.1658 47 R 3.9033 7.2008 118.1135 59.5375 29.8887 179.2656 48 R 3.8920 7.9816 117.1637 59.2009 29.9555 178.3254 49 D 4.2950 8.0037 117.3858 57.5476 41.0941 178.1876 50 V 3.5483 8.2292 118.6841 66.5488 30.8847 177.1020 51 A 4.2122 8.2847 120.0956 55.1764 17.9975 179.3828 52 R 4.0952 8.8183 116.3388 58.6173 30.2340 179.2146 53 V 3.7191 7.7771 116.2659 66.2986 31.6310 178.0534 54 K 4.1217 8.8043 117.5279 59.5537 32.0431 179.2561 55 T 4.0003 9.0606 116.8452 66.6038 68.6489 175.4667 56 L 4.8789 8.6651 122.0435 54.6839 43.8673 178.2646 57 L 3.7706 8.4066 119.1459 56.4013 41.6615 173.9400 58 N 4.5378 7.8442 117.7810 54.2462 39.7707 176.0941 59 E 4.0556 8.0700 116.2351 59.4543 30.1991 179.8485 60 K 3.6198 7.7463 117.5395 59.3018 32.0759 175.9279 61 A 4.0353 7.9761 125.1085 53.6535 17.4264 177.0378 62 G 5.0588 7.4554 121.6460 47.1276 0.0000 171.0497 63 A 4.2860 8.0056 128.5650 51.8838 19.3047 176.9458 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 M 8.16 4.44 0.00 2.42 2.14 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 2 K 8.10 3.52 0.00 1.82 1.70 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 3 A 8.48 4.13 1.30 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 4 K 8.28 3.90 0.00 1.72 1.91 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.50 7.81 5 E 7.80 4.13 0.00 1.97 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 2.71 2.42 0.00 6 L 8.09 4.07 0.00 1.84 1.58 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.75 4.16 0.00 2.03 2.09 0.00 3.19 0.00 0.00 3.34 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 8 E 7.66 4.02 0.00 2.24 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 2.51 2.44 0.00 9 K 7.57 3.82 0.00 2.15 1.78 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.40 7.81 10 S 8.70 4.06 0.00 4.04 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 11 V 7.81 3.54 2.08 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 0.89 0.00 0.00 0.93 0.00 0.00 12 E 7.71 4.44 0.00 2.20 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 2.33 2.24 0.00 13 E 8.10 4.15 0.00 2.08 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 2.53 2.35 0.00 14 L 8.03 3.94 0.00 1.64 1.74 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.14 4.42 0.00 2.99 3.07 0.00 0.00 6.14 7.22 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 16 T 7.98 3.93 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 1.21 0.00 0.00 17 E 8.02 4.60 0.00 2.24 2.22 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 2.37 2.60 0.00 18 L 7.88 3.91 0.00 1.89 1.87 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.89 4.01 0.00 2.02 1.72 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.66 4.99 0.00 2.97 2.87 0.00 0.00 6.64 6.62 0.00 0.00 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 L 8.29 4.26 0.00 1.77 1.69 1.06 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.09 3.89 0.00 1.52 1.78 0.84 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.92 4.57 0.00 2.07 2.20 0.00 3.66 0.00 0.00 2.99 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.47 0.00 24 E 7.48 4.26 0.00 2.32 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 0.00 2.33 2.35 0.00 25 Q 8.40 4.05 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 26 F 8.49 4.11 0.00 3.13 3.07 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 27 N 9.95 4.16 0.00 2.98 2.92 0.00 0.00 7.16 6.62 0.00 0.00 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 L 7.25 3.89 0.00 1.80 1.71 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.94 3.89 0.00 1.93 1.71 0.00 3.14 0.00 0.00 3.21 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 30 M 7.58 3.88 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 31 Q 9.35 4.29 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 32 A 8.17 4.66 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 33 A 7.80 4.22 1.30 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 34 S 7.90 4.69 0.00 4.19 3.82 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 0.00 0.00 0.00 35 G 8.29 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 10.03 2.80 0.00 2.43 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.55 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 37 L 5.62 3.89 0.00 1.69 1.64 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.55 4.73 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 7.04 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 39 Q 7.70 4.71 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 40 S 8.32 4.10 0.00 4.06 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 41 H 8.56 4.01 0.00 3.39 3.62 0.00 5.48 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.28 3.79 0.00 1.91 1.72 0.63 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.87 4.08 0.00 1.75 1.74 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.25 3.92 0.00 1.87 2.00 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.55 7.81 45 Q 8.70 4.30 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 5.71 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 46 V 8.52 3.73 2.08 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 0.99 0.00 0.00 0.99 0.00 0.00 47 R 7.20 3.90 0.00 2.23 1.96 0.00 3.19 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 48 R 7.98 3.89 0.00 1.85 1.99 0.00 3.30 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 49 D 8.00 4.30 0.00 2.85 2.68 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 0.00 0.00 0.00 0.00 50 V 8.23 3.55 2.27 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 0.96 0.00 0.00 0.96 0.00 0.00 51 A 8.28 4.21 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 52 R 8.82 4.10 0.00 1.98 2.03 0.00 3.15 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 0.00 53 V 7.78 3.72 2.22 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 0.91 0.00 0.00 1.04 0.00 0.00 54 K 8.80 4.12 0.00 1.84 1.86 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.64 7.81 55 T 9.06 4.00 4.42 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 1.21 0.00 0.00 56 L 8.67 4.88 0.00 1.73 1.63 0.92 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.41 3.77 0.00 1.75 1.93 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.84 4.54 0.00 2.88 2.89 0.00 0.00 6.73 8.05 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 59 E 8.07 4.06 0.00 2.36 2.23 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 2.30 2.51 0.00 60 K 7.75 3.62 0.00 1.85 1.94 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.60 7.81 61 A 7.98 4.04 1.29 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 0.00 0.00 0.00 62 G 7.46 5.06 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 0.00 0.00 0.00 63 A 8.01 4.29 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