NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.6881 8.3249 122.8251 58.1402 40.7012 175.5995 2 V 3.7480 6.9502 122.1262 59.9291 32.1362 177.0217 3 N 4.5280 8.9986 120.1702 55.9418 37.8971 175.6644 4 Q 3.9977 8.0720 120.3957 58.9753 28.7310 177.7422 5 H 4.1257 8.1355 118.9049 59.2035 29.4570 177.2355 6 L 3.9655 7.9416 120.8244 57.7874 41.3975 178.8530 7 C 4.2030 8.4042 119.0014 62.6866 31.5431 175.9523 8 G 3.6856 8.3132 107.2001 47.8281 0.0000 175.5011 9 S 3.9809 7.7471 115.4549 61.5715 62.3365 176.0511 10 H 4.2418 7.9452 118.0728 58.4801 28.3626 177.5509 11 L 3.9290 8.2161 121.3050 58.1557 41.4841 180.1516 12 V 3.2545 7.5694 112.0060 64.0614 31.3718 178.3157 13 E 3.9373 7.7683 117.6456 59.2255 29.4030 178.7912 14 A 4.0333 8.0010 120.8936 54.8438 18.3345 179.6154 15 L 3.6397 7.8862 117.8161 57.8982 41.1409 178.8035 16 Y 4.3629 7.9702 119.8399 60.8769 38.4629 178.2027 17 L 3.8935 7.7415 119.8050 58.0912 42.3418 178.8536 18 V 3.8467 7.7802 117.7989 64.4466 31.8825 177.7816 19 C 4.3026 8.6857 117.7782 60.5742 28.3609 175.2556 20 G 3.7832 8.0723 109.0085 46.1800 0.0000 176.5263 21 E 3.9789 8.7645 122.2619 58.7302 29.6325 178.2349 22 R 3.8700 7.7110 118.1890 57.5586 30.2108 178.2023 23 G 3.9632 8.9116 106.5090 45.0199 0.0000 171.7610 24 F 4.9185 7.5557 111.8087 55.8424 40.4338 172.8949 25 F 4.9023 9.0190 123.4276 56.7209 40.2913 174.0362 26 Y 4.6620 9.1898 129.8968 56.2751 38.9743 175.0712 27 T 4.1038 7.3795 118.1585 58.4347 69.2614 171.8959 28 P 4.0530 0.0000 0.0000 63.4138 32.2923 177.0192 29 K 4.1611 8.3965 116.9551 56.8023 31.3977 176.6257 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 4.69 0.00 3.00 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 6.95 3.75 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 0.56 0.00 0.00 0.37 0.00 0.00 3 N 9.00 4.53 0.00 3.17 3.56 0.00 0.00 6.13 7.80 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 4 Q 8.07 4.00 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 8.14 4.13 0.00 3.23 3.41 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 7.94 3.97 0.00 1.79 1.76 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.40 4.20 0.00 3.06 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.98 0.00 3.71 3.98 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 0.00 0.00 0.00 0.00 10 H 7.95 4.24 0.00 3.40 3.32 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 8.22 3.93 0.00 1.72 1.72 1.03 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.57 3.25 2.03 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 0.07 0.00 0.00 0.82 0.00 0.00 13 E 7.77 3.94 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 14 A 8.00 4.03 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 3.64 0.00 0.88 0.31 0.73 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.97 4.36 0.00 3.26 3.26 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 3.89 0.00 1.73 1.84 0.92 0.91 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 18 V 7.78 3.85 2.05 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 0.83 0.00 0.00 0.91 0.00 0.00 19 C 8.69 4.30 0.00 3.25 3.32 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 20 G 8.07 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 0.00 0.00 0.00 21 E 8.76 3.98 0.00 1.95 2.03 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 2.31 2.32 0.00 22 R 7.71 3.87 0.00 1.87 2.03 0.00 3.29 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 23 G 8.91 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 24 F 7.56 4.92 0.00 3.27 3.10 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 0.00 0.00 0.00 25 F 9.02 4.90 0.00 3.00 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 26 Y 9.19 4.66 0.00 3.32 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 7.38 4.10 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 -0.67 0.00 0.00 28 P 0.00 4.05 0.00 2.13 1.97 0.00 3.54 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.00 0.00 29 K 8.40 4.16 0.00 1.86 1.96 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.37 7.81