NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9017 8.3544 109.7388 44.9567 0.0000 174.9545 2 S 3.9600 7.6692 115.9097 59.6553 62.8612 173.1742 3 S 4.8339 7.8491 115.5021 56.5079 66.9018 174.6358 4 G 3.9697 8.5071 113.6079 45.3823 0.0000 174.3738 5 S 4.3915 7.8725 114.8941 60.5686 64.5746 176.1199 6 S 4.1418 8.1937 114.5240 60.5356 62.3954 174.3618 7 G 4.0308 7.7410 107.0669 44.5579 0.0000 172.7375 8 R 4.7146 8.2106 118.0842 54.0520 33.1556 175.7013 9 R 4.6071 8.2440 119.3148 54.5575 33.1803 175.5113 10 H 4.6440 8.7155 119.6179 55.5608 29.6191 174.7403 11 R 4.7510 8.2039 117.3096 54.9864 31.6467 175.5107 12 T 4.5182 7.7714 114.0319 61.6663 72.5374 173.7180 13 I 3.8912 7.6930 123.2206 60.4561 38.9124 174.8388 14 F 5.2030 8.1008 122.8802 55.2069 43.0391 175.1953 15 T 4.4191 8.6518 113.1992 60.6952 71.1438 175.3763 16 D 4.3859 8.6656 122.4487 57.0048 39.0112 178.6137 17 E 3.8176 7.9214 120.3067 58.8988 29.7728 178.5167 18 Q 3.8285 7.6696 117.9860 59.0785 28.8325 179.3074 19 L 3.5067 8.1759 119.9890 57.6539 41.6849 178.6831 20 E 3.7673 8.4214 119.2901 59.5565 29.4218 178.4968 21 A 3.8584 7.7973 120.0674 55.3485 18.4737 179.1518 22 L 3.5716 7.1983 116.5479 58.2505 41.5548 179.9601 23 E 4.3745 8.0402 118.1978 59.5757 29.0980 179.2983 24 N 4.4358 8.5875 116.9508 55.5434 38.5164 177.1094 25 L 4.2331 7.9345 121.8494 57.8517 42.3520 178.5217 26 F 4.8382 8.3615 120.6783 60.6240 39.2058 176.8810 27 Q 4.1462 8.0603 117.6498 58.7448 28.6617 177.9368 28 E 4.2478 7.5707 117.1907 57.9554 30.0975 177.2725 29 T 4.5099 8.2414 114.9256 59.6291 70.2616 174.1114 30 K 3.4119 8.9566 128.7717 58.9551 32.1956 176.4866 31 Y 4.3812 7.8108 117.4576 55.1469 38.8057 173.6530 32 P 4.5646 0.0000 0.0000 62.3501 32.9744 175.7025 33 D 5.0002 8.1715 116.8681 52.4153 44.4896 177.4466 34 V 3.7419 8.4293 122.2051 65.3910 31.1192 178.9814 35 G 3.5528 7.9489 105.4624 47.8807 0.0000 175.7844 36 T 3.9359 7.7034 117.9056 66.1560 68.4654 176.9800 37 R 3.7965 8.4050 120.3581 59.2812 29.8855 178.6196 38 E 3.9304 8.0835 118.2311 59.7877 29.4731 179.6281 39 Q 3.9839 7.9101 117.1225 58.8610 28.7766 178.1835 40 L 3.8472 8.2327 121.4377 58.7947 42.0327 178.3708 41 A 3.9033 8.3356 120.2280 55.9189 18.1492 179.6141 42 R 4.0143 7.9933 114.8767 59.1751 30.0294 179.4066 43 K 4.0192 8.0313 118.7991 58.9127 32.2698 178.3460 44 V 4.0748 7.7326 109.8962 60.2623 32.3363 175.3914 45 H 4.0361 8.0199 114.1789 57.1140 26.2455 173.8111 46 L 4.9252 8.2269 117.0376 52.4240 46.1565 177.0698 47 R 4.4499 8.3265 118.5500 55.1269 32.0292 176.9830 48 E 3.7968 8.6249 124.8012 59.5349 29.9598 178.6982 49 E 3.9442 8.3235 117.9181 59.6919 29.5569 179.4333 50 K 3.9759 8.1333 117.3907 59.6320 31.6918 178.9623 51 V 3.5505 7.8244 118.2982 66.3062 31.1232 177.4786 52 E 3.7480 7.9558 117.1474 59.3080 29.6955 178.5021 53 V 3.7438 7.7556 117.8314 65.9191 31.6042 177.4820 54 W 4.3564 8.3370 127.8759 60.7948 30.4784 177.7823 55 F 3.7311 8.5251 116.5861 60.6149 38.1996 177.6530 56 K 3.9018 7.8774 116.4309 59.5879 32.0167 178.7867 57 N 4.3405 7.8740 115.9222 56.2907 38.5555 177.1722 58 R 3.3273 6.9225 119.2019 59.3088 29.9566 178.9560 59 R 4.0424 7.6223 117.2445 59.4492 30.0893 178.5138 60 A 4.0264 7.6970 120.1650 55.3534 18.2881 179.6682 61 K 3.8436 8.0593 117.0265 59.7405 32.6991 178.6478 62 W 4.4993 8.0564 128.6438 60.2951 30.2824 177.5723 63 R 3.5153 8.0644 117.4224 58.4954 30.0770 177.9910 64 R 4.0602 7.7721 116.6628 59.3636 30.2176 178.3710 65 S 4.1370 8.2775 112.2504 61.1031 62.9691 175.1154 66 G 3.5382 7.2197 108.8842 43.9503 0.0000 172.3147 67 P 4.0018 0.0000 0.0000 64.0920 31.7440 177.4789 68 S 4.0708 6.9411 114.2190 60.8047 62.2155 174.2592 69 S 4.5802 7.9214 112.6328 57.3000 64.3018 173.6242 70 G 4.0252 8.7812 115.0385 45.8566 0.0000 172.9656 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 G 8.35 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 0.00 0.00 0.00 2 S 7.67 3.96 0.00 3.94 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 3 S 7.85 4.83 0.00 3.88 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 4 G 8.51 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 5 S 7.87 4.39 0.00 4.00 4.01 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 0.00 0.00 0.00 6 S 8.19 4.14 0.00 3.86 3.93 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 7 G 7.74 4.03 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 0.00 8 R 8.21 4.71 0.00 1.74 1.79 0.00 3.32 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 9 R 8.24 4.61 0.00 1.76 1.82 0.00 3.22 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 10 H 8.72 4.64 0.00 3.14 3.20 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.20 4.75 0.00 1.91 1.92 0.00 2.97 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 12 T 7.77 4.52 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 0.96 0.00 0.00 13 I 7.69 3.89 1.76 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.59 0.79 0.00 0.00 14 F 8.10 5.20 0.00 3.05 2.89 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 0.00 0.00 0.00 15 T 8.65 4.42 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 1.24 0.00 0.00 16 D 8.67 4.39 0.00 2.88 3.01 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 0.00 0.00 0.00 17 E 7.92 3.82 0.00 2.02 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 2.25 2.31 0.00 18 Q 7.67 3.83 0.00 2.23 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.69 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 19 L 8.18 3.51 0.00 1.79 1.70 1.04 0.94 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 20 E 8.42 3.77 0.00 2.07 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 0.00 2.28 2.33 0.00 21 A 7.80 3.86 1.22 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 0.00 0.00 22 L 7.20 3.57 0.00 0.31 0.13 -0.65 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.04 4.37 0.00 2.18 2.10 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 2.71 2.70 0.00 24 N 8.59 4.44 0.00 2.80 2.86 0.00 0.00 6.52 6.76 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 25 L 7.93 4.23 0.00 1.86 2.05 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.36 4.84 0.00 2.06 3.08 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 27 Q 8.06 4.15 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.91 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 28 E 7.57 4.25 0.00 2.20 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 0.00 2.55 2.41 0.00 29 T 8.24 4.51 4.26 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 1.40 0.00 0.00 30 K 8.96 3.41 0.00 1.81 2.00 0.00 1.41 0.00 0.00 1.36 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.74 1.17 7.81 31 Y 7.81 4.38 0.00 2.79 2.89 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 0.00 0.00 0.00 32 P 0.00 4.56 0.00 2.05 2.06 0.00 3.34 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 1.55 1.16 0.00 33 D 8.17 5.00 0.00 2.67 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.43 3.74 2.06 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 0.83 0.00 0.00 0.91 0.00 0.00 35 G 7.95 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 36 T 7.70 3.94 4.31 0.00 0.00 0.00 0.00 0.00 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 37 R 8.41 3.80 0.00 1.78 1.88 0.00 3.16 0.00 0.00 2.82 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.61 0.00 38 E 8.08 3.93 0.00 2.08 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 2.31 2.51 0.00 39 Q 7.91 3.98 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 40 L 8.23 3.85 0.00 1.83 1.83 0.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.34 3.90 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 4.01 0.00 1.93 1.99 0.00 3.25 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 43 K 8.03 4.02 0.00 1.73 1.95 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.47 7.81 44 V 7.73 4.07 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 0.66 0.00 0.00 0.92 0.00 0.00 45 H 8.02 4.04 0.00 3.26 3.40 0.00 5.62 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.23 4.93 0.00 1.47 1.53 0.53 1.14 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 47 R 8.33 4.45 0.00 1.88 1.86 0.00 3.19 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 48 E 8.62 3.80 0.00 1.98 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 2.37 0.00 49 E 8.32 3.94 0.00 2.07 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 2.41 2.44 0.00 50 K 8.13 3.98 0.00 2.00 2.06 0.00 1.89 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.61 1.56 7.81 51 V 7.82 3.55 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 0.99 0.00 0.00 0.92 0.00 0.00 52 E 7.96 3.75 0.00 1.91 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 0.00 2.28 2.19 0.00 53 V 7.76 3.74 2.42 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 0.98 0.00 0.00 1.08 0.00 0.00 54 W 8.34 4.36 0.00 3.42 3.45 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 0.00 55 F 8.53 3.73 0.00 3.37 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 56 K 7.88 3.90 0.00 1.94 1.88 0.00 1.54 0.00 0.00 1.91 0.00 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.55 7.81 57 N 7.87 4.34 0.00 2.58 2.57 0.00 0.00 7.32 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 6.92 3.33 0.00 0.67 0.66 0.00 2.47 0.00 0.00 2.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 59 R 7.62 4.04 0.00 2.07 2.09 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 60 A 7.70 4.03 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 61 K 8.06 3.84 0.00 1.84 1.89 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.55 7.81 62 W 8.06 4.50 0.00 3.61 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.06 3.52 0.00 2.25 2.46 0.00 3.41 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 64 R 7.77 4.06 0.00 1.99 1.97 0.00 3.22 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 65 S 8.28 4.14 0.00 3.88 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 66 G 7.22 3.54 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 0.00 0.00 0.00 67 P 0.00 4.00 0.00 2.12 2.12 0.00 3.58 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.86 0.00 68 S 6.94 4.07 0.00 3.39 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 69 S 7.92 4.58 0.00 3.81 3.66 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 70 G 8.78 4.03 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 0.00