NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3233 8.2493 123.5831 51.6323 19.9257 176.5337 2 S 4.0400 8.5771 118.1713 57.1172 63.6023 173.1685 3 C 4.3857 8.9614 125.3351 56.5487 44.9699 173.3496 4 N 5.3674 7.2469 120.1231 52.4879 41.9640 175.0122 5 G 3.9791 7.2548 111.4703 46.1831 0.0000 170.4187 6 V 5.0891 7.9857 121.8584 61.3995 34.3164 175.0616 7 C 5.1171 8.6930 119.9750 54.0666 46.0924 172.7509 8 S 4.8351 9.9384 116.8707 57.2805 62.8060 173.4110 9 P 4.3377 0.0000 0.0000 64.6388 31.3020 177.1675 10 F 4.3605 8.0562 115.8240 58.7675 39.4395 176.1925 11 E 4.1759 8.2014 121.3011 56.2481 29.6824 176.1509 12 M 4.6524 8.3375 122.8083 53.2753 34.8655 172.4141 13 P 4.6035 0.0000 0.0000 61.2813 32.4441 174.2679 14 P 4.3363 0.0000 0.0000 63.9557 31.8518 177.1582 15 C 3.9033 9.4145 117.8592 57.9270 37.8378 173.2000 16 G 3.9008 8.1504 103.7734 46.1512 0.0000 174.5136 17 T 4.2222 7.2947 107.7702 61.3857 71.0631 173.5514 18 S 4.1946 8.7923 123.4833 59.4396 63.4865 175.1052 19 A 4.0465 7.6879 123.2787 54.1790 18.3527 176.5499 20 C 4.9407 7.3347 115.7081 55.3068 47.2182 172.8984 21 R 4.8049 8.3808 115.3917 54.5172 32.7087 173.2130 22 C 4.9646 8.6911 121.6295 55.4887 46.1466 172.6505 23 I 3.9312 8.1765 128.0906 58.9096 37.6105 175.2525 24 P 4.7751 0.0000 0.0000 62.2167 29.5200 177.0233 25 V 4.0496 7.1574 110.0499 60.7143 32.2613 176.6201 26 G 4.3988 7.2298 106.4423 45.2322 0.0000 173.8749 27 L 4.2318 8.8463 119.8438 57.5546 41.6202 179.5214 28 V 4.8794 7.6267 108.0119 60.5316 33.4405 174.9052 29 I 4.7370 7.7116 118.5495 59.9318 41.6561 173.7354 30 G 4.8026 9.1287 113.2915 46.0678 0.0000 170.7344 31 Y 5.4028 7.9964 117.9287 55.3491 42.1316 175.5396 32 C 4.8193 9.2220 120.3501 57.0205 35.9847 172.7256 33 R 5.1966 8.9966 123.9912 54.4487 33.4692 173.7079 34 N 4.7464 8.8583 124.0475 51.7102 38.9810 174.0728 35 P 4.8938 0.0000 0.0000 63.2173 31.3406 176.3518 36 S 4.7616 8.8372 112.8013 56.8637 64.1647 174.7544 37 G 3.7618 8.2741 114.2554 46.6233 0.0000 173.1988 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 A 8.25 4.32 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 2 S 8.58 4.04 0.00 4.08 3.90 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 0.00 0.00 0.00 3 C 8.96 4.39 0.00 2.97 3.06 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 0.00 0.00 0.00 0.00 4 N 7.25 5.37 0.00 2.65 2.62 0.00 0.00 7.22 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 7.25 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 6 V 7.99 5.09 2.12 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 1.00 0.00 0.00 0.99 0.00 0.00 7 C 8.69 5.12 0.00 3.05 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.94 4.84 0.00 3.94 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 9 P 0.00 4.34 0.00 1.88 1.99 0.00 4.05 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 10 F 8.06 4.36 0.00 2.94 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.20 4.18 0.00 2.13 1.92 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 2.38 2.31 0.00 12 M 8.34 4.65 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 13 P 0.00 4.60 0.00 2.42 2.03 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 14 P 0.00 4.34 0.00 2.20 2.01 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.29 0.00 15 C 9.41 3.90 0.00 3.13 3.18 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 0.00 16 G 8.15 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.29 4.22 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 1.34 0.00 0.00 18 S 8.79 4.19 0.00 3.90 3.89 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 19 A 7.69 4.05 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.33 4.94 0.00 2.83 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 21 R 8.38 4.80 0.00 1.81 1.92 0.00 2.80 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.51 0.00 22 C 8.69 4.96 0.00 2.97 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 23 I 8.18 3.93 0.56 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.18 0.62 0.00 0.00 24 P 0.00 4.78 0.00 1.98 1.95 0.00 3.55 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 25 V 7.16 4.05 2.19 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 0.75 0.00 0.00 1.16 0.00 0.00 26 G 7.23 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.85 4.23 0.00 1.69 1.81 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.63 4.88 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 0.56 0.00 0.00 0.90 0.00 0.00 29 I 7.71 4.74 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.32 0.95 0.00 0.00 30 G 9.13 4.80 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 0.00 0.00 0.00 31 Y 8.00 5.40 0.00 3.21 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 32 C 9.22 4.82 0.00 3.05 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 33 R 9.00 5.20 0.00 2.20 1.79 0.00 3.23 0.00 0.00 3.65 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 34 N 8.86 4.75 0.00 2.90 2.95 0.00 0.00 6.54 7.78 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 35 P 0.00 4.89 0.00 2.07 2.11 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 36 S 8.84 4.76 0.00 3.79 3.80 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 37 G 8.27 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00