NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0157 8.3549 109.7396 45.6306 0.0000 172.6914 2 I 4.1384 8.2270 121.0182 62.0253 39.7191 172.8987 3 V 3.3857 8.0268 119.6638 65.9153 32.5164 177.3361 4 E 4.0374 8.0965 118.5389 58.5333 29.8231 177.4398 5 Q 4.2007 7.3855 119.2821 59.2995 29.5846 176.8121 6 C 5.2312 7.9170 114.8661 55.4505 41.6088 175.8956 7 C 4.0459 8.4453 121.5079 62.6312 31.4931 174.0656 8 T 4.5580 7.6057 114.0320 62.8913 68.6052 174.0388 9 S 4.4387 7.5500 115.8616 58.0557 65.6893 173.1675 10 I 4.4979 8.0612 121.0371 59.9365 37.5714 175.8462 11 C 4.3371 8.2469 124.4391 56.9603 34.6811 174.3598 12 S 4.7482 7.6544 113.4183 57.0256 66.9946 177.5399 13 L 4.0735 8.2179 124.5517 57.8926 41.6172 178.6852 14 Y 4.2261 8.2334 116.7558 59.9653 37.9813 178.0553 15 Q 3.4538 7.6070 121.1511 58.8238 29.3442 177.7511 16 L 3.8865 7.6565 118.7002 56.7349 41.4315 178.5070 17 E 4.1174 7.8811 118.8220 58.3313 29.4679 176.3620 18 N 4.9170 7.8189 115.0376 53.9977 38.8780 174.9080 19 Y 4.4570 8.0381 113.5214 58.1149 38.4140 176.0153 20 C 4.8296 7.8655 116.1332 59.5668 28.9720 173.7011 21 N 4.5044 8.1507 122.6937 53.6797 38.1264 175.1737 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 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 8.23 4.14 2.13 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.83 0.00 0.00 3 V 8.03 3.39 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 1.02 0.00 0.00 0.94 0.00 0.00 4 E 8.10 4.04 0.00 1.98 1.98 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 2.30 2.25 0.00 5 Q 7.39 4.20 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.16 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 6 C 7.92 5.23 0.00 2.93 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 7 C 8.45 4.05 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 4.56 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 1.21 0.00 0.00 9 S 7.55 4.44 0.00 4.00 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 10 I 8.06 4.50 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 1.41 0.68 0.91 0.00 0.00 11 C 8.25 4.34 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.75 0.00 4.07 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 13 L 8.22 4.07 0.00 1.69 1.70 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.23 4.23 0.00 3.21 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 15 Q 7.61 3.45 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 16 L 7.66 3.89 0.00 1.61 1.56 0.76 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.88 4.12 0.00 2.19 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 2.35 2.54 0.00 18 N 7.82 4.92 0.00 2.82 2.79 0.00 0.00 6.77 6.72 0.00 0.00 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 8.04 4.46 0.00 3.10 2.99 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 20 C 7.87 4.83 0.00 2.96 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 21 N 8.15 4.50 0.00 2.61 2.68 0.00 0.00 6.94 7.53 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