NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 3.8100 7.8827 121.4077 61.2780 37.3663 174.1067 3 D 4.7365 8.2798 125.9449 50.8720 41.4415 173.9514 4 T 4.2134 8.6056 116.0094 60.7950 70.7218 173.6914 5 N 4.0542 7.9632 119.2884 55.3538 37.7313 174.4393 6 V 4.4216 7.2003 117.2936 60.7289 34.6849 175.5309 7 K 4.5750 8.8252 127.7032 56.6580 32.9946 175.7198 8 C 4.5173 8.5102 118.9850 54.2131 42.3193 173.0935 9 S 4.4267 8.4222 120.3605 58.9351 62.6374 173.8166 10 G 4.1406 8.4187 107.4173 44.6175 0.0000 176.0478 11 S 4.1876 8.9167 120.0836 61.2551 63.0510 176.0053 12 S 4.4626 7.9100 114.2577 59.4533 63.4126 175.7146 13 K 4.1330 8.3289 122.7434 59.3104 32.0162 176.1376 14 C 4.3043 8.1001 114.3132 58.6697 41.4956 175.9789 15 V 3.3106 7.4388 120.3140 63.8727 31.1269 177.7122 16 K 4.1516 7.8971 119.5327 58.8832 32.5110 178.1567 17 I 3.9211 7.9074 118.6961 63.6343 38.0947 176.7887 18 C 4.4292 8.9341 119.7403 59.1056 43.1381 175.5358 19 I 4.4577 7.0876 121.5694 64.0642 36.7523 177.3705 20 D 4.4648 7.8964 117.6265 57.1007 41.0909 177.8487 21 R 3.7870 7.8505 118.2428 56.9103 30.2931 176.7503 22 Y 4.4089 8.2503 114.5398 57.8403 39.5609 177.1993 23 N 4.7707 9.1197 116.3306 54.5682 39.5916 174.8618 24 T 4.5917 7.9086 113.7170 61.1212 69.3562 174.5661 25 R 4.5239 8.5220 119.0170 55.3636 30.3772 175.3060 26 G 4.2715 8.4478 106.3662 45.0573 0.0000 171.9268 27 A 5.3758 8.6686 126.4084 50.2833 22.5854 174.8917 28 K 4.6278 9.4868 121.3503 54.8419 36.4965 174.8105 29 C 5.6356 8.9403 126.2967 55.4570 43.4656 172.1739 30 I 4.2814 8.5958 126.4476 62.1368 39.4046 175.9957 31 N 4.8328 8.3392 114.1382 52.6380 37.5454 175.3992 32 G 4.0308 8.8473 107.7604 45.3364 0.0000 173.1953 33 R 5.1372 7.7426 113.9787 54.3872 33.7446 173.7731 34 C 5.0633 9.2977 117.7445 56.5579 37.7679 173.5875 35 T 4.7422 8.9553 121.6411 61.8158 70.9736 172.8208 36 C 5.0277 8.6829 123.8936 55.8682 41.8398 173.7218 37 Y 4.5406 8.7874 122.1510 55.4807 38.0790 174.2548 38 P 4.4479 0.0000 0.0000 62.5088 31.5931 176.5052 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 2 I 7.88 3.81 1.84 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.39 0.89 0.00 0.00 3 D 8.28 4.74 0.00 2.58 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.61 4.21 4.27 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 1.32 0.00 0.00 5 N 7.96 4.05 0.00 2.80 2.88 0.00 0.00 6.81 9.06 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 6 V 7.20 4.42 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 1.06 0.00 0.00 0.97 0.00 0.00 7 K 8.83 4.57 0.00 1.67 1.74 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.51 7.81 8 C 8.51 4.52 0.00 3.02 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.42 4.43 0.00 3.85 3.88 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 10 G 8.42 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.92 4.19 0.00 3.92 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 12 S 7.91 4.46 0.00 3.87 3.91 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 13 K 8.33 4.13 0.00 1.83 1.91 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 14 C 8.10 4.30 0.00 3.21 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.44 3.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 16 K 7.90 4.15 0.00 1.85 1.97 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.49 7.81 17 I 7.91 3.92 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.04 0.99 0.00 0.00 18 C 8.93 4.43 0.00 3.16 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.09 4.46 2.03 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 1.66 0.45 0.95 0.00 0.00 20 D 7.90 4.46 0.00 2.65 2.78 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 0.00 0.00 0.00 21 R 7.85 3.79 0.00 1.94 1.27 0.00 3.25 0.00 0.00 3.24 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.89 0.00 22 Y 8.25 4.41 0.00 2.97 2.67 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 23 N 9.12 4.77 0.00 2.82 2.89 0.00 0.00 5.80 7.72 0.00 0.00 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 T 7.91 4.59 4.27 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 1.31 0.00 0.00 25 R 8.52 4.52 0.00 1.91 1.96 0.00 3.12 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 26 G 8.45 4.27 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 0.00 27 A 8.67 5.38 1.22 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 0.00 0.00 28 K 9.49 4.63 0.00 1.83 1.77 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.40 7.81 29 C 8.94 5.64 0.00 3.00 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 30 I 8.60 4.28 1.95 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 1.50 0.97 1.06 0.00 0.00 31 N 8.34 4.83 0.00 2.86 2.88 0.00 0.00 6.32 7.01 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 32 G 8.85 4.03 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 0.00 0.00 0.00 33 R 7.74 5.14 0.00 2.05 2.01 0.00 2.91 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 34 C 9.30 5.06 0.00 2.84 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 35 T 8.96 4.74 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 36 C 8.68 5.03 0.00 2.72 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 37 Y 8.79 4.54 0.00 2.79 2.86 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 0.00 0.00 0.00 38 P 0.00 4.45 0.00 2.04 1.96 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00