NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9889 8.3549 109.7463 45.5708 0.0000 173.8379 2 I 3.7107 7.1048 120.9822 62.6111 38.2745 173.9783 3 V 3.6236 8.5453 120.3379 64.9330 32.8269 175.6732 4 E 4.7178 7.4567 119.2629 54.8309 29.4905 174.5202 5 Q 4.6024 7.6252 121.9242 56.6488 34.7838 174.7026 6 C 5.4934 7.9842 114.2948 57.7073 41.6158 175.8240 7 C 4.0060 8.0717 116.3991 62.2007 27.9029 174.4976 8 T 4.2660 7.6701 108.0712 62.3612 69.5198 174.9643 9 S 4.2557 7.7915 113.7171 57.2861 65.6782 173.8677 10 I 3.6023 8.7312 127.0799 61.3359 36.7233 176.4665 11 C 4.4264 8.5700 122.6305 56.8105 35.8801 174.4128 12 S 4.4766 8.1305 116.0678 57.8283 63.8918 175.3743 13 L 3.9536 8.1556 124.1007 57.8511 41.6029 179.0653 14 Y 4.2344 7.5774 116.2453 61.2205 37.4121 178.3560 15 Q 4.0571 8.1990 118.5028 58.8916 28.7118 178.2812 16 L 4.5294 7.7856 117.7946 56.5872 41.6503 177.9571 17 E 4.1971 8.1298 118.9411 58.3510 29.7991 177.5494 18 N 4.7677 7.6812 114.1985 53.0173 37.1904 175.1787 19 Y 4.6411 7.4244 115.0154 58.5203 39.6724 175.9985 20 C 4.4963 7.8778 117.0353 58.5752 29.3593 173.0113 21 N 4.4874 8.6422 119.1333 54.1155 38.4918 174.7259 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 8.35 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 2 I 7.10 3.71 1.65 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.27 0.76 0.00 0.00 3 V 8.55 3.62 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 0.86 0.00 0.00 0.89 0.00 0.00 4 E 7.46 4.72 0.00 1.98 1.91 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 2.22 2.26 0.00 5 Q 7.63 4.60 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.15 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 6 C 7.98 5.49 0.00 3.12 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 7 C 8.07 4.01 0.00 3.21 2.98 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 8 T 7.67 4.27 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 1.21 0.00 0.00 9 S 7.79 4.26 0.00 3.99 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 I 8.73 3.60 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.53 0.91 0.00 0.00 11 C 8.57 4.43 0.00 3.01 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 12 S 8.13 4.48 0.00 3.81 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.16 3.95 0.00 1.35 1.30 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.58 4.23 0.00 3.06 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 15 Q 8.20 4.06 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.99 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 16 L 7.79 4.53 0.00 1.78 1.79 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.13 4.20 0.00 2.34 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 2.21 0.00 18 N 7.68 4.77 0.00 2.66 2.81 0.00 0.00 6.72 7.28 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 19 Y 7.42 4.64 0.00 3.25 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 20 C 7.88 4.50 0.00 3.00 2.88 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 0.00 0.00 0.00 21 N 8.64 4.49 0.00 2.70 2.72 0.00 0.00 6.88 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00