NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 H 4.8394 8.4293 117.8400 55.5676 30.1526 172.0995 20 K 4.3239 8.4443 123.5111 52.5262 34.0848 174.0130 21 P 4.5165 0.0000 0.0000 61.2503 33.1440 174.9687 22 P 4.5217 0.0000 0.0000 61.4363 32.0152 174.3331 23 P 4.4194 0.0000 0.0000 62.7475 31.7924 175.8875 24 E 4.7198 8.2432 119.7033 53.7358 31.7662 174.5455 25 P 4.1938 0.0000 0.0000 62.5936 32.0785 175.1839 26 D 4.6702 8.0947 119.1882 52.8465 41.6547 176.0517 27 W 4.6473 8.8072 125.6681 56.7830 29.6564 177.2350 28 S 4.2153 9.1020 117.1447 61.1071 62.3203 174.3328 29 N 4.8751 8.1044 118.8286 52.1305 39.6305 173.3423 30 T 4.8456 8.2600 121.9587 62.0835 71.4357 174.0315 31 V 4.4952 7.8648 121.6223 61.0139 34.4630 172.0636 32 P 4.4664 0.0000 0.0000 62.6183 32.0162 177.0080 33 V 3.6286 8.4345 121.8890 65.8387 31.6882 176.3340 34 N 4.6837 7.8746 119.6434 52.0232 37.4370 175.0753 35 K 4.1948 8.4767 123.9731 58.4625 32.6280 177.4995 36 T 4.7114 7.3458 106.6060 59.6400 71.8277 173.0585 37 I 4.0501 8.1564 123.6469 59.8731 37.7547 174.6714 38 P 4.5626 0.0000 0.0000 62.5620 32.0993 175.7845 39 V 4.3319 7.9160 111.4208 59.4854 34.7668 175.3169 40 D 4.6509 8.4754 123.5657 53.3522 40.7371 176.2202 41 T 4.2291 8.2901 118.7861 62.2813 69.2767 174.8174 42 Q 4.1462 8.1088 127.0858 57.2038 29.5621 175.3517 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 19 H 8.43 4.84 0.00 3.17 3.28 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.44 4.32 0.00 1.94 1.81 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.50 7.81 21 P 0.00 4.52 0.00 2.21 2.12 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 22 P 0.00 4.52 0.00 2.19 2.10 0.00 3.78 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 1.99 1.98 0.00 23 P 0.00 4.42 0.00 2.03 2.01 0.00 3.63 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 2.01 2.09 0.00 24 E 8.24 4.72 0.00 1.96 1.89 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 2.24 2.25 0.00 25 P 0.00 4.19 0.00 1.25 1.62 0.00 3.80 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 26 D 8.09 4.67 0.00 2.61 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 27 W 8.81 4.65 0.00 3.30 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 28 S 9.10 4.22 0.00 3.84 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 29 N 8.10 4.88 0.00 2.64 2.71 0.00 0.00 6.80 7.70 0.00 0.00 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 T 8.26 4.85 4.38 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 1.41 0.00 0.00 31 V 7.86 4.50 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 0.74 0.00 0.00 1.01 0.00 0.00 32 P 0.00 4.47 0.00 2.10 1.98 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 33 V 8.43 3.63 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 0.81 0.00 0.00 0.96 0.00 0.00 34 N 7.87 4.68 0.00 2.76 3.02 0.00 0.00 6.93 7.61 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 35 K 8.48 4.19 0.00 1.75 1.87 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.37 7.81 36 T 7.35 4.71 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 37 I 8.16 4.05 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.43 0.91 0.00 0.00 38 P 0.00 4.56 0.00 2.18 2.06 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 39 V 7.92 4.33 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 0.74 0.00 0.00 0.93 0.00 0.00 40 D 8.48 4.65 0.00 2.75 2.56 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 0.00 0.00 0.00 0.00 41 T 8.29 4.23 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 42 Q 8.11 4.15 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00