NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9385 8.3501 109.7398 45.8609 0.0000 174.2974 2 A 4.3743 8.1855 117.7133 49.8656 19.0819 169.2466 3 V 4.1604 7.1764 116.7588 63.9752 35.6179 175.4520 4 E 4.3036 7.7324 122.7781 55.5775 28.0021 177.0416 5 Q 4.7384 6.8210 127.2703 54.5603 31.3387 175.5234 6 C 6.2768 7.5454 130.1479 58.9343 40.2722 175.8401 7 C 4.6543 7.7993 112.2324 58.7048 29.0247 173.5184 8 T 4.7179 8.3555 108.0028 60.2287 69.7916 175.2284 9 S 4.9150 7.1374 114.8562 59.4849 65.1982 178.1196 10 I 4.5778 7.9247 121.6497 60.0107 40.8782 175.1534 11 C 4.8591 8.5572 132.9248 57.0762 35.2081 175.7925 12 S 4.6165 8.4474 125.0392 57.1865 64.5745 174.1546 13 L 3.9612 8.8232 128.1015 59.0073 41.9313 177.7442 14 Y 3.8759 8.4574 116.3676 60.9196 37.8372 178.0406 15 Q 3.4937 8.3418 118.7714 59.2647 28.8491 179.3238 16 L 4.2914 7.9560 121.3418 58.1202 42.0520 178.5690 17 E 3.9656 9.0910 120.2517 58.7305 29.3123 177.5222 18 N 4.7109 7.7157 114.1805 54.0097 38.8180 175.5390 19 Y 4.5366 7.7858 117.9585 59.9122 38.9982 176.2643 20 C 4.5500 7.8401 117.7917 59.2007 29.9222 173.4654 21 N 4.5312 8.7125 118.0488 54.5937 38.0813 174.8474 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 3.94 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 0.00 0.00 0.00 2 A 8.19 4.37 1.05 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 0.00 0.00 3 V 7.18 4.16 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 0.85 0.00 0.00 0.89 0.00 0.00 4 E 7.73 4.30 0.00 2.11 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 2.27 2.33 0.00 5 Q 6.82 4.74 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 7.49 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 6 C 7.55 6.28 0.00 3.10 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 7 C 7.80 4.65 0.00 3.07 3.01 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 0.00 0.00 0.00 8 T 8.36 4.72 4.24 0.00 0.00 0.00 0.00 0.00 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 7.14 4.91 0.00 3.93 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 4.58 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 0.92 0.93 0.00 0.00 11 C 8.56 4.86 0.00 3.03 2.85 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 12 S 8.45 4.62 0.00 3.87 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 8.82 3.96 0.00 1.70 1.87 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.46 3.88 0.00 3.06 3.02 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 15 Q 8.34 3.49 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 16 L 7.96 4.29 0.00 1.94 1.77 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 9.09 3.97 0.00 1.98 1.84 0.00 0.00 0.00 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 2.23 0.00 18 N 7.72 4.71 0.00 2.79 2.65 0.00 0.00 6.91 7.46 0.00 0.00 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 7.79 4.54 0.00 3.26 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 20 C 7.84 4.55 0.00 3.01 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 21 N 8.71 4.53 0.00 2.72 2.74 0.00 0.00 6.61 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00