NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9588 8.2127 109.7471 45.0488 0.0000 174.5721 2 I 2.9082 7.4946 118.9210 62.4157 37.4865 172.8341 3 V 3.3716 7.6039 119.2916 65.9451 31.5904 176.9430 4 E 3.5553 7.9826 118.4866 59.1535 29.2023 178.4129 5 Q 4.2580 7.7120 118.8522 58.2611 29.3543 176.1923 6 C 4.9050 8.4553 116.6526 56.1014 41.9084 174.2367 7 C 4.4066 8.3886 120.0484 61.2812 32.1099 174.5589 8 H 4.5593 8.0181 114.3681 57.7066 29.0343 175.0138 9 S 4.7618 7.5086 114.7045 56.5941 66.9399 172.7712 10 I 4.2213 8.1778 122.7897 60.6167 37.8177 174.5228 11 C 5.1087 8.4832 118.2246 53.3399 45.1705 173.8774 12 S 4.7360 8.1639 116.2697 56.8647 65.6399 175.0298 13 L 3.9938 8.4821 123.8615 58.9660 41.3983 178.6544 14 Y 3.9769 8.1717 115.0429 61.1831 38.2812 178.1083 15 Q 4.2039 8.1090 118.5444 58.9825 29.0056 178.7339 16 V 3.8409 8.2327 119.5956 66.0091 31.5184 177.5320 17 E 4.1021 8.2996 118.4313 58.4543 29.2375 177.8462 18 N 4.4400 7.7229 114.5871 55.0579 38.5412 174.9441 19 Y 4.5681 7.3204 116.9402 57.7878 38.2982 175.5847 20 C 4.5139 7.5354 118.0961 58.8009 29.1983 173.6245 21 N 4.5256 8.5279 117.2487 53.8400 38.1013 175.4022 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 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 2 I 7.49 2.91 0.56 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.41 0.56 0.00 0.00 3 V 7.60 3.37 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.82 0.00 0.00 4 E 7.98 3.56 0.00 2.02 1.93 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 2.46 2.36 0.00 5 Q 7.71 4.26 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.55 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 6 C 8.46 4.90 0.00 2.99 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 7 C 8.39 4.41 0.00 2.83 3.02 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 8 H 8.02 4.56 0.00 3.30 3.32 0.00 5.72 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.51 4.76 0.00 4.14 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.22 1.88 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 1.48 0.51 0.92 0.00 0.00 11 C 8.48 5.11 0.00 3.23 3.29 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 12 S 8.16 4.74 0.00 3.94 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.48 3.99 0.00 1.83 1.83 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.17 3.98 0.00 2.89 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 15 Q 8.11 4.20 0.00 2.34 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 16 V 8.23 3.84 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.99 0.00 0.00 17 E 8.30 4.10 0.00 2.21 1.95 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 2.19 2.28 0.00 18 N 7.72 4.44 0.00 2.36 2.35 0.00 0.00 6.86 7.12 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 19 Y 7.32 4.57 0.00 3.15 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 20 C 7.54 4.51 0.00 2.91 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.53 4.53 0.00 2.71 2.73 0.00 0.00 6.77 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