NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7698 8.3544 109.7365 45.9634 0.0000 171.4602 2 S 3.5020 8.3325 124.9307 56.2812 63.0910 169.1953 3 Q 4.7356 8.1515 125.3896 54.3406 31.8587 174.3360 4 I 4.6528 7.8509 115.6033 60.2079 40.2789 174.4418 5 T 4.4992 8.3352 117.1508 64.2736 70.6180 173.7033 6 G 4.1993 7.3505 110.9432 45.4161 0.0000 173.0409 7 T 4.5865 7.2008 119.4189 64.0696 76.4400 174.4222 8 C 4.5065 7.9465 119.4377 55.8399 39.4980 172.2862 9 P 4.4926 0.0000 0.0000 62.4180 31.7990 177.3070 10 S 3.7431 8.9503 117.2852 62.1973 62.4413 177.4120 11 V 3.8018 7.9211 114.9393 64.4263 31.0456 178.8603 12 C 4.5157 8.8712 116.4691 59.5065 40.0537 175.5722 13 S 4.1909 8.3425 115.2018 60.9560 62.0389 174.1259 14 G 3.5262 7.9636 108.9714 46.4516 0.0000 172.9971 15 D 4.1966 7.2829 126.1535 52.9598 41.3667 176.7322 16 C 4.5056 8.1902 129.1637 56.2009 38.7799 173.0370 17 Y 4.5062 6.9192 117.6862 55.9726 38.7161 175.1201 18 P 4.4102 0.0000 0.0000 65.5929 31.6258 177.6976 19 E 4.0909 8.1968 116.5096 58.8824 29.6639 178.0427 20 C 4.4390 8.7662 117.9094 56.0036 34.7722 172.0091 21 P 4.5375 0.0000 0.0000 61.1218 32.0448 173.6230 22 P 4.3506 0.0000 0.0000 64.2990 31.2424 177.1772 23 G 3.9610 8.9793 110.8659 45.9464 0.0000 174.6037 24 C 4.5249 7.9759 117.7826 58.9930 40.7270 171.6520 25 C 4.8836 7.2087 110.9579 53.7353 43.7845 174.0091 26 G 4.6106 7.5408 113.0304 46.0875 0.0000 172.9628 27 Q 4.6113 8.2607 127.6985 54.1043 29.2846 176.8157 28 V 4.1717 7.0256 109.2596 60.3327 35.1367 174.8535 29 N 4.0156 8.7694 123.6486 54.0866 36.5288 173.9539 30 L 4.7838 7.8617 128.8337 52.7382 42.2245 176.5132 31 N 4.5050 7.7152 120.1799 53.3490 37.0260 174.4165 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 3.77 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 0.00 0.00 0.00 2 S 8.33 3.50 0.00 4.08 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 3 Q 8.15 4.74 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.47 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 4 I 7.85 4.65 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 1.42 0.44 0.91 0.00 0.00 5 T 8.34 4.50 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 1.21 0.00 0.00 6 G 7.35 4.20 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 0.00 7 T 7.20 4.59 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 1.22 0.00 0.00 8 C 7.95 4.51 0.00 2.97 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 9 P 0.00 4.49 0.00 2.25 2.01 0.00 3.67 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 10 S 8.95 3.74 0.00 4.05 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 7.92 3.80 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 1.06 0.00 0.00 1.13 0.00 0.00 12 C 8.87 4.52 0.00 3.07 3.15 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 13 S 8.34 4.19 0.00 3.85 3.89 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 14 G 7.96 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.28 4.20 0.00 1.58 1.88 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 16 C 8.19 4.51 0.00 2.85 2.98 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 17 Y 6.92 4.51 0.00 3.10 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 18 P 0.00 4.41 0.00 2.08 2.23 0.00 3.82 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 19 E 8.20 4.09 0.00 1.85 2.03 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 2.25 2.28 0.00 20 C 8.77 4.44 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 21 P 0.00 4.54 0.00 2.23 2.21 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 22 P 0.00 4.35 0.00 2.06 2.06 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 23 G 8.98 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 0.00 0.00 0.00 24 C 7.98 4.52 0.00 3.15 3.16 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 0.00 25 C 7.21 4.88 0.00 3.02 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 26 G 7.54 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.61 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.67 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 28 V 7.03 4.17 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 0.69 0.00 0.00 0.93 0.00 0.00 29 N 8.77 4.02 0.00 2.81 2.80 0.00 0.00 7.11 7.75 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 30 L 7.86 4.78 0.00 1.65 1.61 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 31 N 7.72 4.50 0.00 2.77 2.71 0.00 0.00 6.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00