NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 V 4.9167 7.8132 119.7915 63.5435 33.2285 178.0828 5 C 4.5831 8.2070 113.7521 56.4265 40.0763 172.5847 6 S 4.6084 8.5642 113.8873 57.7399 65.0539 173.9094 7 E 4.1865 7.7753 121.1357 56.3231 29.8487 176.2322 8 Q 4.1918 8.2867 119.5536 55.1370 29.4639 176.2763 9 A 3.0072 7.8832 124.6212 52.2746 18.3339 176.5950 10 E 4.5019 7.9556 123.2721 54.4046 31.6808 175.3853 11 T 4.1427 8.6859 121.9360 63.1782 67.7863 175.1179 12 G 3.9852 8.1980 107.7863 44.0897 0.0000 171.1448 13 P 4.4096 0.0000 0.0000 64.6865 32.1779 177.6278 14 C 4.5757 7.8688 116.6510 56.8185 40.8749 173.6086 15 R 4.6170 8.2216 119.5214 55.9951 30.6112 176.1305 16 A 4.4500 7.4725 121.2775 51.4455 21.9113 177.1489 17 M 5.0675 8.3936 114.8549 54.3526 33.0580 174.1344 18 I 4.6973 8.8714 124.7247 59.1628 40.6921 174.3444 19 S 4.6358 8.5616 121.4541 57.2857 64.2222 173.6221 20 R 4.9284 7.8797 122.2963 54.5729 35.3193 173.7139 21 W 5.5131 9.2989 119.0327 55.4945 33.0769 174.8283 22 Y 5.5104 9.3106 120.0386 55.5667 41.3117 173.8087 23 F 4.3343 9.5011 125.8666 57.9265 40.3767 173.9486 24 D 4.5865 7.9586 127.3661 53.2179 41.7461 177.7606 25 V 3.7937 8.4866 119.6057 64.4809 32.3048 177.9200 26 T 3.9870 8.0595 115.5784 66.7304 68.0103 175.3085 27 E 4.0220 8.6215 119.1122 56.2124 29.7932 177.9342 28 G 3.9801 7.6431 106.1276 45.6390 0.0000 172.9089 29 K 4.7283 7.0218 117.2095 54.7675 36.7699 172.6409 30 C 4.9061 8.5825 115.0563 53.7402 40.4876 173.6060 31 A 4.3749 7.8309 126.0499 50.8750 19.7918 174.1752 32 P 4.8134 0.0000 0.0000 61.6494 33.4106 175.1413 33 F 4.9089 8.8474 116.3063 55.9827 42.2376 172.6796 34 F 4.7962 8.7350 117.1563 55.9172 40.4862 175.5940 35 Y 4.6797 9.3861 127.1182 57.2234 40.5737 175.5903 36 G 4.2794 7.3023 106.8209 44.2100 0.0000 174.4259 37 G 3.9238 6.6120 108.6922 45.3949 0.0000 172.8394 38 C 5.0510 6.8533 111.4080 53.8042 45.7729 175.9178 39 G 3.5016 9.4897 108.7873 47.8418 0.0000 173.5711 40 G 3.9993 9.6754 111.2809 46.0033 0.0000 171.0405 41 N 4.8946 8.1955 120.7365 51.8831 39.8456 174.5509 42 R 3.8990 8.3551 115.8696 58.4306 30.7673 177.1626 43 N 4.8084 7.8886 118.3712 52.8938 37.6067 175.0013 44 N 5.1905 7.2183 115.7252 52.0842 42.1965 172.9711 45 F 4.6947 8.5122 123.9354 56.9639 41.4159 176.7739 46 D 3.7073 7.4720 120.5936 53.1768 43.7961 175.9416 47 T 4.6379 8.4072 104.3582 59.3321 72.1998 175.0187 48 E 3.0328 7.8658 126.0746 59.2848 29.0308 178.6839 49 E 3.7226 7.8916 118.3103 59.6711 29.3872 178.1000 50 Y 4.2829 8.9847 120.4542 60.2833 38.8123 176.6331 51 C 2.4500 7.7293 119.0222 59.1868 43.4949 175.0990 52 M 3.8233 7.4927 118.5563 58.4566 31.6535 178.2510 53 A 4.0551 7.8179 119.4332 55.1481 18.6279 179.3477 54 V 3.7137 7.2908 115.1736 64.7242 31.8598 175.3067 55 C 4.0964 8.2586 120.1465 56.7296 41.2483 173.3436 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 4 V 7.81 4.92 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 1.17 0.00 0.00 0.92 0.00 0.00 5 C 8.21 4.58 0.00 2.99 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.56 4.61 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.78 4.19 0.00 2.08 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 0.00 2.33 2.30 0.00 8 Q 8.29 4.19 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 9 A 7.88 3.01 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.96 4.50 0.00 1.82 1.78 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 2.25 2.29 0.00 11 T 8.69 4.14 4.62 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 1.30 0.00 0.00 12 G 8.20 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.16 2.19 0.00 3.62 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 1.98 2.11 0.00 14 C 7.87 4.58 0.00 2.87 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 15 R 8.22 4.62 0.00 1.73 1.87 0.00 3.17 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 16 A 7.47 4.45 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 17 M 8.39 5.07 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 18 I 8.87 4.70 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 1.01 0.00 0.00 19 S 8.56 4.64 0.00 3.60 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 20 R 7.88 4.93 0.00 1.00 1.94 0.00 3.46 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.56 0.00 21 W 9.30 5.51 0.00 3.43 3.23 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 0.00 22 Y 9.31 5.51 0.00 3.21 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 9.50 4.33 0.00 2.98 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 24 D 7.96 4.59 0.00 2.22 2.21 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 25 V 8.49 3.79 2.15 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 0.98 0.00 0.00 0.98 0.00 0.00 26 T 8.06 3.99 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 27 E 8.62 4.02 0.00 1.86 1.86 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 2.26 2.19 0.00 28 G 7.64 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 0.00 0.00 0.00 29 K 7.02 4.73 0.00 1.75 1.81 0.00 1.23 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.17 7.81 30 C 8.58 4.91 0.00 3.06 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.83 4.37 1.04 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 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.81 0.00 1.35 0.49 0.00 3.52 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.16 0.00 33 F 8.85 4.91 0.00 3.07 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 34 F 8.73 4.80 0.00 2.97 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 9.39 4.68 0.00 2.51 2.80 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 0.00 0.00 0.00 36 G 7.30 4.28 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 0.00 37 G 6.61 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 6.85 5.05 0.00 3.03 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 39 G 9.49 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 9.68 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.20 4.89 0.00 2.96 2.79 0.00 0.00 5.90 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.36 3.90 0.00 1.77 1.91 0.00 3.19 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 43 N 7.89 4.81 0.00 2.93 2.87 0.00 0.00 6.83 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 7.22 5.19 0.00 2.67 2.49 0.00 0.00 7.06 7.02 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 45 F 8.51 4.69 0.00 3.58 3.08 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 0.00 0.00 0.00 46 D 7.47 3.71 0.00 2.83 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 47 T 8.41 4.64 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 1.23 0.00 0.00 48 E 7.87 3.03 0.00 1.16 1.12 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 1.47 1.47 0.00 49 E 7.89 3.72 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 50 Y 8.98 4.28 0.00 2.82 3.28 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 51 C 7.73 2.45 0.00 2.35 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 M 7.49 3.82 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.48 0.00 53 A 7.82 4.06 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.29 3.71 1.82 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 0.89 0.00 0.00 0.77 0.00 0.00 55 C 8.26 4.10 0.00 2.69 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00