NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7336 8.0501 120.3705 62.6851 32.8143 174.7868 2 A 4.2732 7.4111 129.4910 48.4469 20.7128 175.9629 3 Y 4.2701 8.1894 118.3380 59.7483 39.3674 176.4894 4 W 4.2687 6.8044 117.4218 58.9591 28.9830 176.2961 5 R 4.9934 5.8511 118.6382 54.2305 27.4021 173.4761 6 Q 4.1462 7.3852 119.0214 56.0042 31.9374 174.9019 7 A 4.4464 7.8547 129.9908 51.1202 20.0057 177.1956 8 G 3.9333 8.5434 113.2885 45.7966 0.0000 170.9505 9 L 5.1507 7.9969 118.4281 52.1935 45.6845 176.8463 10 S 4.6421 8.4148 114.4277 58.1663 64.6150 174.4279 11 Y 3.7661 8.6802 124.7007 59.9377 38.5360 177.7630 12 I 3.7439 7.7477 120.8035 64.3586 37.2910 178.0302 13 R 3.7888 7.8202 119.2021 59.2710 30.0451 177.4588 14 Y 3.5080 7.2544 119.5100 60.6128 38.5013 178.2450 15 S 3.6871 7.8455 114.0063 61.2766 62.4846 175.5046 16 Q 3.8525 7.8846 122.2616 59.4561 28.6276 178.9642 17 I 3.5530 7.5209 120.2121 64.5622 37.1849 178.0358 18 C 3.8156 7.5430 117.2543 62.8187 27.9346 176.0638 19 A 3.9256 8.1247 122.5041 55.2028 17.9320 179.6718 20 K 3.8946 7.8824 117.3376 59.4086 32.0087 178.9806 21 A 4.0078 7.7512 120.5424 54.7992 17.9903 179.4573 22 V 3.6855 7.6011 116.7080 66.1064 31.3773 178.5614 23 R 3.9974 7.6380 116.6664 59.0595 29.9988 178.1888 24 D 4.4901 8.0693 116.8399 55.5975 41.0344 176.8406 25 A 4.4288 7.3340 125.0563 52.0834 19.3865 176.2971 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 V 8.05 3.73 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 0.83 0.00 0.00 0.85 0.00 0.00 2 A 7.41 4.27 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.19 4.27 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 W 6.80 4.27 0.00 3.57 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 R 5.85 4.99 0.00 0.73 1.34 0.00 2.82 0.00 0.00 2.93 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.71 0.00 6 Q 7.39 4.15 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 7 A 7.85 4.45 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 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 0.00 0.00 0.00 9 L 8.00 5.15 0.00 2.10 1.79 1.06 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.41 4.64 0.00 3.98 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.68 3.77 0.00 3.21 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 12 I 7.75 3.74 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.73 0.90 0.00 0.00 13 R 7.82 3.79 0.00 1.91 2.04 0.00 3.20 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 14 Y 7.25 3.51 0.00 1.82 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 0.00 0.00 0.00 15 S 7.85 3.69 0.00 3.45 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 16 Q 7.88 3.85 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 17 I 7.52 3.55 1.70 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.34 0.76 0.00 0.00 18 C 7.54 3.82 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 3.93 1.31 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 0.00 0.00 0.00 20 K 7.88 3.89 0.00 1.95 1.84 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.41 7.81 21 A 7.75 4.01 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.60 3.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.96 0.00 0.00 23 R 7.64 4.00 0.00 1.94 1.95 0.00 3.18 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 24 D 8.07 4.49 0.00 2.64 2.70 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 0.00 0.00 0.00 0.00 25 A 7.33 4.43 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00