NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 5.7518 8.1827 122.8406 57.9980 40.7655 174.8477 2 V 3.3984 7.9542 127.1134 65.6360 31.2131 176.3763 3 N 4.1716 8.4301 117.4156 57.0878 39.1688 176.2668 4 Q 4.0932 7.8900 118.4776 58.6040 28.7383 177.8131 5 Y 4.0403 8.3669 121.4717 60.7111 38.3412 178.0139 6 L 3.9338 8.3559 120.3310 57.7633 41.6818 179.0196 7 C 4.2285 8.2464 118.8819 62.5050 31.4239 175.9124 8 G 3.5981 8.2444 107.3270 47.5514 0.0000 175.4634 9 S 3.8430 7.5218 115.4988 61.8091 62.4531 176.2041 10 H 4.2007 7.7794 117.6687 58.5282 28.3030 177.7136 11 L 3.9061 7.9026 121.0425 57.9372 41.4404 179.8250 12 V 3.2092 7.3003 117.8056 65.6457 31.4742 177.7171 13 E 3.8794 7.7548 117.7251 59.1059 29.4199 178.7020 14 A 3.9886 7.8825 120.7471 54.9577 18.4352 179.5824 15 L 3.6445 7.9526 117.9108 57.8335 41.4663 178.8461 16 Y 4.2093 7.8086 119.4401 60.9748 38.4691 178.5013 17 L 3.9162 7.6430 117.8325 57.7038 41.8281 179.4122 18 V 3.6898 7.8577 117.4238 66.2792 31.8279 177.6110 19 C 4.3150 8.8607 116.3970 60.1671 28.1388 175.2218 20 G 3.6287 8.2329 109.6023 46.4259 0.0000 176.8795 21 E 3.9897 8.8001 121.9128 58.9239 29.5850 178.3047 22 R 3.8812 7.6716 117.4659 57.2871 30.2160 177.6925 23 G 3.8211 9.2280 104.5750 45.2793 0.0000 171.4339 24 F 4.8925 7.2717 111.6885 56.3366 40.0833 172.8915 25 F 4.2371 9.0402 119.3014 55.5696 41.2696 174.6422 26 Y 4.8015 8.6944 125.1101 56.0950 40.1362 175.1403 27 T 4.3283 7.8256 117.6913 58.6674 69.3498 172.5677 28 P 3.6275 0.0000 0.0000 64.6725 31.5601 176.8396 29 K 4.3931 6.5733 114.3838 56.3710 34.3816 174.3796 30 T 4.2203 8.2103 120.8020 63.3761 69.4115 174.1276 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 8.18 5.75 0.00 3.18 2.93 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 2 V 7.95 3.40 1.90 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 1.06 0.00 0.00 0.99 0.00 0.00 3 N 8.43 4.17 0.00 2.61 2.71 0.00 0.00 7.07 6.98 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 4 Q 7.89 4.09 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 5 Y 8.37 4.04 0.00 3.20 3.19 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 0.00 0.00 0.00 0.00 6 L 8.36 3.93 0.00 1.72 1.72 0.94 0.97 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 7 C 8.25 4.23 0.00 2.99 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 8 G 8.24 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 3.84 0.00 3.61 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 4.20 0.00 3.35 3.28 0.00 5.68 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 7.90 3.91 0.00 1.80 1.66 1.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.30 3.21 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.17 0.00 0.00 13 E 7.75 3.88 0.00 2.07 1.97 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 2.25 2.36 0.00 14 A 7.88 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 3.64 0.00 0.69 0.41 0.68 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.81 4.21 0.00 3.29 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 17 L 7.64 3.92 0.00 1.70 1.71 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.86 3.69 2.02 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 0.81 0.00 0.00 0.94 0.00 0.00 19 C 8.86 4.31 0.00 3.16 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 3.99 0.00 1.95 2.01 0.00 0.00 0.00 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 2.31 0.00 22 R 7.67 3.88 0.00 1.91 2.04 0.00 3.21 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 23 G 9.23 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.27 4.89 0.00 3.14 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 25 F 9.04 4.24 0.00 3.18 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 8.69 4.80 0.00 3.19 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 4.33 4.18 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 1.25 0.00 0.00 28 P 0.00 3.63 0.00 2.19 2.15 0.00 3.64 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 29 K 6.57 4.39 0.00 1.51 1.72 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.24 7.81 30 T 8.21 4.22 4.23 0.00 0.00 0.00 0.00 0.00 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