NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8599 8.3249 122.8246 58.2239 40.7494 174.6364 2 V 3.7418 6.5402 117.8274 59.4170 32.3337 177.3019 3 N 4.2856 8.7203 120.0504 56.5791 37.5952 175.5605 4 Q 4.0162 8.0128 119.9512 58.5657 28.9462 178.0944 5 H 4.1618 8.0681 118.8786 59.3298 29.8608 177.2250 6 L 3.9413 7.8528 120.8470 57.6965 41.3551 178.9755 7 C 4.2314 8.5359 119.2401 62.5394 31.5540 175.7593 8 G 3.7018 8.2470 107.3332 47.9281 0.0000 175.2390 9 S 3.9201 7.7767 115.0501 61.6718 62.3387 176.1924 10 H 4.7548 7.7865 119.8658 58.0129 28.4268 177.7506 11 L 3.9233 8.0543 121.0360 57.8505 41.4923 179.6313 12 V 3.3034 7.5896 118.2916 65.8081 31.3651 177.9193 13 E 3.9505 7.7597 115.8374 59.3190 29.4592 179.0350 14 A 3.9817 8.0590 121.7966 54.7665 18.3832 179.6288 15 L 3.6555 8.0603 118.0198 57.7544 41.3695 178.9773 16 Y 4.2797 7.6549 119.4875 60.7583 38.5115 178.3793 17 L 3.8746 7.5696 118.0887 57.7336 41.8642 179.3577 18 V 3.6755 7.7548 117.1852 66.3008 31.7142 177.5960 19 C 4.2938 8.6691 116.6395 60.3967 28.3470 175.0615 20 G 3.6158 8.2245 110.1648 46.2872 0.0000 176.7813 21 E 4.0790 8.7907 120.8748 58.5435 29.7676 178.5946 22 R 3.8822 7.6886 118.8526 57.2345 30.2430 177.6623 23 G 3.9038 9.2236 105.2885 45.1615 0.0000 171.1841 24 F 4.9108 7.4772 112.4915 55.9453 40.3745 172.8680 25 F 5.0032 7.9563 114.8753 55.0231 40.0953 173.8593 26 Y 4.5863 8.8540 123.6992 55.9871 40.5275 174.8195 27 T 4.3602 7.8001 117.4085 59.0172 70.1318 172.6722 28 P 3.9751 0.0000 0.0000 64.4979 31.9345 177.2930 29 K 4.1646 7.2642 126.0050 54.8006 31.6511 181.8979 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 F 8.32 4.86 0.00 2.97 3.09 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 0.00 0.00 0.00 0.00 2 V 6.54 3.74 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 0.60 0.00 0.00 0.36 0.00 0.00 3 N 8.72 4.29 0.00 3.02 3.39 0.00 0.00 6.12 7.44 0.00 0.00 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 Q 8.01 4.02 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 8.07 4.16 0.00 3.18 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.85 3.94 0.00 1.86 1.73 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.54 4.23 0.00 3.07 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 8 G 8.25 3.70 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 0.00 0.00 0.00 9 S 7.78 3.92 0.00 3.75 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 10 H 7.79 4.75 0.00 3.32 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.05 3.92 0.00 1.82 1.71 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.59 3.30 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 1.04 0.00 0.00 0.27 0.00 0.00 13 E 7.76 3.95 0.00 2.24 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 0.00 2.48 2.31 0.00 14 A 8.06 3.98 1.32 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 15 L 8.06 3.66 0.00 0.71 0.44 0.61 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.65 4.28 0.00 3.28 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.57 3.87 0.00 1.81 1.69 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.75 3.68 2.06 0.00 0.00 0.00 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 0.94 0.00 0.00 19 C 8.67 4.29 0.00 3.17 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.22 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.79 4.08 0.00 2.08 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 0.00 2.27 2.27 0.00 22 R 7.69 3.88 0.00 1.97 2.08 0.00 3.22 0.00 0.00 3.49 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 23 G 9.22 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 0.00 0.00 0.00 24 F 7.48 4.91 0.00 2.95 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 7.96 5.00 0.00 3.23 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 26 Y 8.85 4.59 0.00 3.18 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.80 4.36 4.20 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 1.28 0.00 0.00 28 P 0.00 3.98 0.00 2.22 2.28 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 29 K 7.26 4.16 0.00 1.81 1.61 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.24 7.81