NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1278 7.9127 114.0606 61.4039 33.9097 176.9560 2 S 4.0799 7.9164 113.7525 59.7823 62.9322 170.5833 3 V 3.8560 8.5492 114.2905 63.7567 33.0149 177.5227 4 D 4.7325 8.0054 120.1972 57.1121 40.6480 177.0656 5 P 4.2416 0.0000 0.0000 65.6767 31.3117 177.7715 6 F 3.9178 7.9836 120.4405 61.4974 39.1549 176.6956 7 Y 4.2815 8.3604 116.6927 59.6163 37.9228 177.6800 8 E 3.4297 7.1178 120.6956 59.1391 29.6383 178.4971 9 M 4.1233 7.9788 116.3387 56.8123 31.8387 177.0259 10 L 4.0601 7.6588 120.9833 53.9218 42.2173 177.7423 11 A 4.1173 8.6373 126.4065 54.8815 18.8843 179.3309 12 A 4.1736 7.8774 117.1089 54.8285 18.8229 178.9635 13 R 4.0908 7.4862 115.1379 59.0302 30.2517 177.1649 14 K 4.2486 7.5691 116.9398 57.4534 31.0666 177.1582 15 K 4.1263 8.7858 125.5624 58.1812 32.1088 178.5434 16 R 4.2377 7.9990 122.4854 58.6948 30.8992 178.7496 17 I 3.8524 7.7084 113.1477 63.7684 37.9059 177.8677 18 S 4.0909 8.1285 114.6907 61.2998 62.1074 176.3580 19 V 3.6522 7.0866 120.7493 64.7515 31.3925 177.8012 20 K 4.0807 8.0215 119.9400 59.1365 31.8038 178.9408 21 K 4.0010 8.2886 118.3196 59.4426 32.0862 179.2865 22 K 4.2819 7.8054 116.9715 58.1614 32.8666 178.5331 23 Q 4.4155 7.4782 118.8159 53.8078 27.0038 173.1519 24 E 4.0905 7.8912 123.2676 55.4378 30.3006 176.7897 25 Q 4.2904 8.4411 125.5827 54.6637 29.7500 174.4105 26 P 4.4184 0.0000 0.0000 63.2293 31.4069 176.2987 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 7.91 4.13 2.11 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 0.78 0.00 0.00 0.95 0.00 0.00 2 S 7.92 4.08 0.00 3.96 3.86 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 3 V 8.55 3.86 2.12 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 0.79 0.00 0.00 0.96 0.00 0.00 4 D 8.01 4.73 0.00 3.08 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.24 0.00 2.29 2.32 0.00 3.81 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.07 0.00 6 F 7.98 3.92 0.00 3.45 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 7 Y 8.36 4.28 0.00 3.30 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.12 3.43 0.00 1.76 1.80 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 1.52 2.21 0.00 9 M 7.98 4.12 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 10 L 7.66 4.06 0.00 1.74 1.58 0.82 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.64 4.12 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 12 A 7.88 4.17 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 13 R 7.49 4.09 0.00 2.11 2.24 0.00 3.52 0.00 0.00 3.37 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.15 0.00 14 K 7.57 4.25 0.00 1.96 2.02 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.68 1.86 7.81 15 K 8.79 4.13 0.00 1.80 1.67 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.70 7.81 16 R 8.00 4.24 0.00 1.81 1.97 0.00 3.29 0.00 0.00 3.39 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 17 I 7.71 3.85 2.05 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 1.01 0.00 0.00 18 S 8.13 4.09 0.00 3.97 4.21 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 19 V 7.09 3.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 20 K 8.02 4.08 0.00 2.04 2.03 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.49 7.81 21 K 8.29 4.00 0.00 2.00 1.87 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.65 1.65 7.81 22 K 7.81 4.28 0.00 1.92 1.88 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.66 1.63 7.81 23 Q 7.48 4.42 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.88 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 24 E 7.89 4.09 0.00 1.93 1.87 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 2.29 2.33 0.00 25 Q 8.44 4.29 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 26 P 0.00 4.42 0.00 2.18 2.03 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00