NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0180 8.2127 109.7473 45.2611 0.0000 173.5910 2 I 2.9854 8.0238 118.9811 62.4004 37.4804 172.9034 3 V 3.6231 8.3303 119.8272 66.1446 31.7324 177.0659 4 E 3.9596 8.0883 116.5536 59.5438 28.0382 178.8671 5 Q 4.1449 8.2379 119.3323 58.7725 29.1124 176.5017 6 C 4.4656 8.6041 116.2263 56.6551 41.0851 174.6335 7 C 4.2112 8.0220 117.6785 60.5530 28.3897 175.4992 8 T 4.1965 7.7291 111.2017 63.0945 69.0918 174.7306 9 S 4.7021 6.9826 113.6035 55.4185 66.3255 173.1846 10 I 3.9200 8.3317 122.5858 61.9145 37.2309 176.3156 11 C 4.9705 8.5762 123.1516 55.4717 42.2184 174.4961 12 S 4.5287 9.4508 120.0353 57.7787 65.0040 175.4963 13 L 4.0031 8.3063 121.2274 57.8955 40.9702 179.3927 14 Y 4.0139 7.7160 115.8172 61.1379 38.0118 178.0000 15 Q 4.1948 8.2963 119.0628 58.9564 28.7254 178.7907 16 L 4.2650 8.0985 120.1448 57.7018 41.6761 178.9126 17 E 3.9039 8.4509 119.3443 59.3664 29.1627 178.6235 18 N 4.2475 7.6344 115.6783 55.9646 38.8241 175.8008 19 Y 4.4758 7.9094 116.4545 57.5933 38.2153 175.3900 20 C 4.5055 7.3600 118.2112 59.5424 29.0918 173.2461 21 N 4.5106 8.5345 118.7788 53.8725 38.5669 174.7784 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 G 8.21 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.02 2.99 0.62 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.09 0.65 0.00 0.00 3 V 8.33 3.62 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 0.99 0.00 0.00 0.87 0.00 0.00 4 E 8.09 3.96 0.00 1.97 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 0.00 2.32 2.44 0.00 5 Q 8.24 4.14 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 6 C 8.60 4.47 0.00 2.99 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 7 C 8.02 4.21 0.00 3.07 2.96 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 8 T 7.73 4.20 4.25 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 1.29 0.00 0.00 9 S 6.98 4.70 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.33 3.92 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.54 0.93 0.00 0.00 11 C 8.58 4.97 0.00 3.00 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 12 S 9.45 4.53 0.00 4.13 4.10 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 13 L 8.31 4.00 0.00 1.40 1.56 0.83 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.72 4.01 0.00 3.02 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 Q 8.30 4.19 0.00 2.45 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 16 L 8.10 4.26 0.00 1.89 1.79 0.93 0.62 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 17 E 8.45 3.90 0.00 2.11 2.20 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 2.32 2.37 0.00 18 N 7.63 4.25 0.00 2.41 2.35 0.00 0.00 7.00 7.32 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 19 Y 7.91 4.48 0.00 3.15 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 20 C 7.36 4.51 0.00 3.06 2.87 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 0.00 21 N 8.53 4.51 0.00 2.67 2.69 0.00 0.00 6.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00