NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0241 8.2133 109.7485 45.5488 0.0000 175.8928 2 I 3.5713 8.3368 120.0341 63.0715 37.4831 172.7475 3 V 3.5641 8.5761 120.4390 65.9015 31.6929 177.7632 4 E 3.8182 8.0025 118.0182 59.2435 29.3874 178.6274 5 Q 3.9510 8.2977 119.7911 59.6087 28.8823 177.6511 6 C 4.0930 8.0904 116.0969 60.1754 40.3058 175.4377 7 C 4.2662 7.3862 118.5140 62.3190 31.5802 175.5066 8 T 4.0951 8.2939 110.3120 62.7902 68.8407 174.4636 9 S 4.7244 9.1410 114.0732 57.6606 61.8372 176.0618 10 I 4.7787 8.2862 110.4987 59.5250 40.2659 172.1289 11 C 4.9479 8.2857 113.3630 53.6338 43.6238 173.8026 12 S 4.9026 8.9324 116.3654 56.8263 66.0120 175.2710 13 L 3.9296 8.2008 122.9030 58.2886 41.1342 179.3532 14 Y 4.1588 7.5218 115.1835 61.2882 38.1530 178.3782 15 Q 4.1880 7.9251 118.6445 58.9555 28.8213 178.7255 16 L 4.3448 8.0659 119.9432 57.4363 41.1545 178.5595 17 E 4.1674 8.1748 118.4958 57.9845 29.3010 177.8445 18 N 4.4134 7.8955 115.0775 55.9279 38.7442 175.6392 19 Y 4.5091 7.7346 116.5303 57.6010 38.6319 175.5020 20 C 4.4716 7.0132 117.1550 59.3117 29.0440 173.4814 21 N 4.5516 8.5437 117.4458 53.8077 38.1908 175.4398 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 8.21 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 2 I 8.34 3.57 2.19 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 1.12 0.00 0.00 3 V 8.58 3.56 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 0.93 0.00 0.00 0.39 0.00 0.00 4 E 8.00 3.82 0.00 2.24 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 2.41 2.32 0.00 5 Q 8.30 3.95 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 6 C 8.09 4.09 0.00 3.13 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 7 C 7.39 4.27 0.00 2.90 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 8 T 8.29 4.10 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 1.25 0.00 0.00 9 S 9.14 4.72 0.00 3.76 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 10 I 8.29 4.78 1.88 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 1.48 0.84 0.92 0.00 0.00 11 C 8.29 4.95 0.00 3.23 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 12 S 8.93 4.90 0.00 4.20 4.11 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 13 L 8.20 3.93 0.00 1.23 1.53 0.77 0.76 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 14 Y 7.52 4.16 0.00 2.99 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 15 Q 7.93 4.19 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 16 L 8.07 4.34 0.00 1.93 1.82 0.93 0.77 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 17 E 8.17 4.17 0.00 2.17 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 2.33 2.37 0.00 18 N 7.90 4.41 0.00 2.60 2.45 0.00 0.00 6.92 7.45 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 19 Y 7.73 4.51 0.00 3.10 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 20 C 7.01 4.47 0.00 3.01 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 21 N 8.54 4.55 0.00 2.73 2.74 0.00 0.00 6.78 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