NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3031 8.1576 119.9932 56.8509 33.9315 173.6433 2 E 4.6975 8.6151 115.6958 53.3946 32.8357 173.1544 3 G 2.3516 6.6038 106.8587 45.0473 0.0000 171.8793 4 Y 4.7722 7.0522 116.5323 57.2661 39.3318 175.6660 5 L 4.4127 8.6098 124.0627 54.7253 42.9766 176.4291 6 V 4.9261 8.1828 121.4931 59.7905 34.5305 174.5582 7 N 4.7030 9.5954 123.8936 53.2616 39.1089 176.0627 8 K 4.2893 9.0878 126.2990 59.1847 32.5288 178.1517 9 S 4.4634 8.3521 114.3598 59.9348 63.3986 175.1430 10 T 4.2051 8.2242 108.5460 61.1061 69.8155 175.7704 11 G 4.0011 8.6885 108.6079 46.4802 0.0000 172.2354 12 C 4.9631 8.0312 117.1391 55.2431 42.6162 173.6198 13 K 5.0557 8.1964 119.9289 55.9966 33.1198 175.9977 14 Y 4.4420 8.7442 119.6346 57.1120 39.1823 175.7193 15 G 4.3589 8.7624 112.0316 46.0358 0.0000 171.7275 16 C 5.0180 8.5095 114.8105 54.4066 44.6136 174.4404 17 L 4.1534 8.8422 124.8426 57.4642 42.2465 176.7413 18 K 4.0945 7.9286 120.7917 56.0152 31.8802 176.3497 19 L 4.2702 8.2915 126.6999 55.1344 43.5711 179.4147 20 G 3.8748 8.2239 108.2953 46.1800 0.0000 175.2828 21 E 4.1219 8.8677 127.0525 56.1325 29.7988 176.2528 22 N 4.8252 8.5890 123.6959 51.1506 41.5414 174.2662 23 E 4.1096 8.9180 128.8848 58.8065 29.7015 179.6323 24 G 3.5520 8.2764 106.3894 48.1469 0.0000 175.3473 25 C 4.3423 8.2853 119.2028 59.2956 40.2326 175.4678 26 D 4.2681 8.2947 120.0059 57.1235 40.6750 178.2418 27 K 3.9134 7.9709 119.9700 59.7175 32.0443 178.5975 28 E 3.9513 7.7675 116.9975 59.6013 29.6249 178.3325 29 C 4.2808 8.5355 118.8883 59.2215 43.4641 175.2431 30 K 4.0254 7.8649 118.1735 56.5716 32.4335 177.2214 31 A 4.0172 7.2358 122.9544 52.2261 18.7610 178.4874 32 K 3.6402 8.7285 122.9036 59.2844 32.3842 177.7747 33 N 4.5381 8.1104 114.6734 54.7193 37.9143 175.8268 34 Q 4.1452 8.0934 117.1466 57.2424 29.6859 176.9483 35 G 3.7978 8.8281 104.3145 46.2623 0.0000 173.7392 36 G 4.0195 8.0106 107.2099 45.5375 0.0000 174.3729 37 S 4.8265 8.8560 113.6780 59.4617 65.2793 173.6121 38 Y 5.1074 7.6438 119.1921 56.6433 41.8054 173.3661 39 G 4.4644 8.2856 112.4767 44.9321 0.0000 171.0366 40 Y 4.9107 7.9777 117.9381 55.6748 42.0082 172.6392 41 C 4.9682 8.7653 121.6037 56.5047 43.5290 171.7680 42 Y 4.8843 8.7939 126.8261 56.0828 41.6339 174.7772 43 A 3.3961 8.7202 130.5113 53.4102 15.4961 176.5701 44 F 4.4220 7.9275 112.8459 58.7171 36.7269 174.8764 45 A 5.0099 7.5419 119.1914 50.6677 23.2059 176.0903 46 C 4.6441 9.4574 120.6017 56.9986 38.6347 172.5335 47 W 4.9877 9.0478 134.9740 55.6851 32.7318 173.8201 48 C 5.3477 8.3682 126.7059 54.6159 46.9989 172.6326 49 E 4.7160 9.2455 124.0620 54.9677 32.6236 176.2814 50 G 4.2258 8.5955 105.5115 46.3372 0.0000 173.9186 51 L 4.1830 7.7904 119.4033 53.2805 42.3686 175.5034 52 P 4.5366 0.0000 0.0000 62.0803 32.3853 176.8951 53 E 3.9062 8.9114 119.8821 59.8381 29.4129 179.1037 54 S 4.2040 7.9843 111.2823 60.3748 63.3367 173.9986 55 T 4.3386 7.7527 119.5906 61.4083 69.0022 173.0499 56 P 4.4612 0.0000 0.0000 62.8051 32.1822 175.2045 57 T 4.8401 7.8528 108.9767 59.5055 72.1508 172.6990 58 Y 4.2759 8.8149 124.4161 57.4040 39.2119 173.6653 59 P 4.0463 0.0000 0.0000 60.6998 33.9409 174.8714 60 L 4.2118 7.9871 120.7724 53.4683 42.2455 176.6857 61 P 4.2771 0.0000 0.0000 65.2088 31.1900 176.6563 62 N 4.9365 7.9237 113.1919 51.9738 38.0112 174.4772 63 K 4.3339 7.8648 120.9374 55.0662 33.0301 175.2114 64 S 4.3698 8.2621 119.3798 58.2004 63.1572 174.6820 65 C 4.9593 8.4625 123.7091 56.0824 44.2302 173.7261 66 S 4.1862 8.0375 118.7169 58.1946 62.2234 173.3979 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 K 8.16 4.30 0.00 1.91 2.02 0.00 1.36 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.49 1.34 7.81 2 E 8.62 4.70 0.00 2.03 1.92 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 2.27 2.69 0.00 3 G 6.60 2.35 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 0.00 4 Y 7.05 4.77 0.00 3.03 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.61 4.41 0.00 1.23 0.89 0.34 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.18 4.93 2.33 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 0.80 0.00 0.00 1.17 0.00 0.00 7 N 9.60 4.70 0.00 2.49 2.70 0.00 0.00 6.96 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 8 K 9.09 4.29 0.00 1.81 1.89 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.53 7.81 9 S 8.35 4.46 0.00 3.98 3.90 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 10 T 8.22 4.21 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 1.17 0.00 0.00 11 G 8.69 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 0.00 0.00 0.00 12 C 8.03 4.96 0.00 2.87 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 13 K 8.20 5.06 0.00 1.37 1.58 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.16 0.48 7.81 14 Y 8.74 4.44 0.00 2.84 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 15 G 8.76 4.36 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 0.00 0.00 0.00 16 C 8.51 5.02 0.00 3.03 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 17 L 8.84 4.15 0.00 1.69 1.80 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.93 4.09 0.00 1.80 1.77 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.49 7.81 19 L 8.29 4.27 0.00 1.60 1.46 0.61 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.22 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 21 E 8.87 4.12 0.00 1.99 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 0.00 2.38 2.44 0.00 22 N 8.59 4.83 0.00 2.91 2.66 0.00 0.00 7.20 7.65 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 23 E 8.92 4.11 0.00 2.12 2.02 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 2.43 2.49 0.00 24 G 8.28 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 0.00 0.00 0.00 0.00 25 C 8.29 4.34 0.00 3.06 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 26 D 8.29 4.27 0.00 2.92 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 K 7.97 3.91 0.00 2.07 1.93 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.50 7.81 28 E 7.77 3.95 0.00 1.91 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 2.58 2.58 0.00 29 C 8.54 4.28 0.00 2.84 3.26 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 0.00 0.00 0.00 30 K 7.86 4.03 0.00 1.99 1.86 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.17 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.60 7.81 31 A 7.24 4.02 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 32 K 8.73 3.64 0.00 1.73 1.87 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.44 7.81 33 N 8.11 4.54 0.00 2.88 2.94 0.00 0.00 5.98 7.39 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 34 Q 8.09 4.15 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 35 G 8.83 3.80 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 0.00 0.00 0.00 36 G 8.01 4.02 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 0.00 0.00 0.00 37 S 8.86 4.83 0.00 3.95 4.15 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 0.00 0.00 0.00 38 Y 7.64 5.11 0.00 3.07 3.03 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 0.00 0.00 0.00 39 G 8.29 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.98 4.91 0.00 3.27 2.81 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 0.00 0.00 0.00 41 C 8.77 4.97 0.00 3.05 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 42 Y 8.79 4.88 0.00 3.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.72 3.40 0.82 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 44 F 7.93 4.42 0.00 3.24 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.54 5.01 1.03 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 0.00 0.00 0.00 0.00 0.00 46 C 9.46 4.64 0.00 2.86 2.96 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 47 W 9.05 4.99 0.00 3.08 2.07 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 48 C 8.37 5.35 0.00 2.68 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 49 E 9.25 4.72 0.00 2.17 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 0.00 2.70 2.42 0.00 50 G 8.60 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 0.00 0.00 0.00 0.00 51 L 7.79 4.18 0.00 1.70 1.53 0.73 0.79 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 52 P 0.00 4.54 0.00 2.20 2.15 0.00 3.78 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 53 E 8.91 3.91 0.00 1.96 2.07 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 2.31 2.26 0.00 54 S 7.98 4.20 0.00 3.96 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 55 T 7.75 4.34 4.28 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 1.19 0.00 0.00 56 P 0.00 4.46 0.00 2.17 2.04 0.00 3.69 0.00 0.00 3.79 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 57 T 7.85 4.84 4.16 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 1.02 0.00 0.00 58 Y 8.81 4.28 0.00 3.08 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 59 P 0.00 4.05 0.00 1.63 0.74 0.00 3.70 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 60 L 7.99 4.21 0.00 1.89 1.60 0.98 0.90 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 61 P 0.00 4.28 0.00 2.15 2.17 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 62 N 7.92 4.94 0.00 2.77 2.84 0.00 0.00 5.72 7.13 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 63 K 7.86 4.33 0.00 1.73 1.67 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.55 7.81 64 S 8.26 4.37 0.00 3.86 3.74 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 0.00 0.00 0.00 65 C 8.46 4.96 0.00 2.98 3.25 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 0.00 66 S 8.04 4.19 0.00 3.93 3.74 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 0.00 0.00 0.00