NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3672 8.1127 119.6555 56.1047 32.4036 173.6001 5 E 4.7093 8.3854 120.8610 53.2026 32.1701 173.7051 6 C 4.3785 9.6779 128.4142 59.5868 32.7822 173.6405 7 D 4.7059 8.5412 124.1780 55.4132 39.5537 175.3707 8 Y 4.5536 7.7822 118.1069 58.6712 41.2283 176.3507 9 C 3.8289 8.0131 113.5739 58.5927 30.7559 175.2518 10 G 3.9988 8.2643 106.7288 44.6155 0.0000 173.2825 11 T 4.2957 7.6209 109.9234 61.3961 70.5044 173.2737 12 D 4.8830 8.4990 122.7991 54.2071 41.3668 176.3636 13 I 4.0053 8.4522 126.0686 60.6568 37.6560 175.9115 14 E 4.0111 8.9048 128.3865 55.0895 30.0059 174.1268 15 P 4.1501 0.0000 0.0000 64.5554 31.4257 175.8271 16 G 3.9918 9.0600 107.2355 46.6044 0.0000 173.3670 17 T 4.5891 7.8527 113.6361 62.7151 72.6421 174.0733 18 G 4.1679 8.9793 110.9687 45.0886 0.0000 172.8803 19 T 4.7618 8.9146 115.4995 61.6656 72.3115 172.8319 20 M 5.0280 8.7597 124.9307 53.9265 34.1614 174.4338 21 F 4.9150 9.3692 129.8281 56.9093 41.3377 174.4625 22 V 4.2250 7.8317 126.6094 61.8459 32.2251 175.5337 23 H 4.0595 9.0339 126.1811 54.7615 29.5544 176.4605 24 K 3.8292 8.6816 121.6907 59.8279 31.8889 177.8087 25 D 4.3911 8.0412 116.4879 54.8840 39.2443 176.3393 26 G 3.6951 7.6446 106.2723 45.1574 0.0000 174.0524 27 A 4.2513 9.9265 123.1688 52.7524 19.7525 176.5209 28 T 4.9761 8.3482 114.7087 62.0970 72.1317 174.0313 29 T 4.5632 8.8025 121.6588 62.2039 72.5949 172.9580 30 H 5.0829 10.1646 126.2399 54.9913 29.8594 174.5930 31 F 5.0722 9.5505 123.9352 56.2938 40.2386 177.2521 32 C 4.3305 9.0910 117.4444 60.1193 30.6775 173.9683 33 S 4.7298 7.7844 114.0552 55.7854 66.7402 174.9405 34 S 4.8128 8.5499 119.0666 60.9620 62.7781 176.1762 35 K 3.7611 8.1021 122.8115 59.6155 31.7596 178.3229 36 C 4.4302 7.8835 115.2392 62.9753 28.2110 175.5221 37 E 2.6572 7.8277 120.0665 59.5428 28.8099 179.6398 38 N 4.3022 8.1313 114.4945 55.9282 38.6252 176.9572 39 N 4.5812 7.9825 117.9406 55.8028 38.6362 177.3150 40 A 4.0164 7.9968 122.6693 55.3753 18.3463 179.4596 41 D 4.1549 7.9404 115.8015 57.0434 40.9778 177.9718 42 L 4.0730 7.3579 117.8385 55.8101 41.8474 177.9504 43 G 3.9930 8.8077 107.3699 45.2221 0.0000 173.8962 44 R 4.3348 7.6393 117.5462 55.4926 31.2804 175.5031 45 E 4.6750 8.4490 118.9508 54.4524 31.6201 177.1622 46 A 3.5286 8.2573 127.2240 55.2200 18.4088 179.5022 47 R 3.8703 7.7079 113.2261 58.5764 30.2540 177.0083 48 N 4.6879 8.4676 113.7778 52.6991 39.0712 174.3668 49 L 4.6671 7.1837 119.9551 52.7334 43.0170 177.4794 50 E 4.0488 8.8440 124.0406 58.4188 29.6691 178.0769 51 W 4.4600 7.8396 114.3025 57.9388 29.0762 176.6427 52 T 3.6161 6.6543 117.5650 62.8050 68.3347 175.2482 53 D 4.2961 8.6469 126.0490 57.8682 41.2326 178.2274 54 T 3.8360 7.9278 115.1046 66.6196 68.5471 175.4577 55 A 3.9889 7.6830 122.1374 55.0312 18.6794 177.4816 56 R 4.0898 7.9092 118.7604 56.5548 30.1061 176.3624 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 4 R 8.11 4.37 0.00 1.77 1.88 0.00 2.99 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 5 E 8.39 4.71 0.00 1.94 1.76 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 2.14 2.45 0.00 6 C 9.68 4.38 0.00 3.06 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 7 D 8.54 4.71 0.00 2.56 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.78 4.55 0.00 2.68 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 9 C 8.01 3.83 0.00 2.84 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.62 4.30 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 12 D 8.50 4.88 0.00 2.60 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.45 4.01 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.57 0.99 0.00 0.00 14 E 8.90 4.01 0.00 2.07 1.86 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 2.39 2.38 0.00 15 P 0.00 4.15 0.00 2.22 2.08 0.00 3.95 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 16 G 9.06 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 17 T 7.85 4.59 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 G 8.98 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.91 4.76 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 20 M 8.76 5.03 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.35 0.00 21 F 9.37 4.92 0.00 3.21 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 22 V 7.83 4.22 1.87 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 0.71 0.00 0.00 0.84 0.00 0.00 23 H 9.03 4.06 0.00 3.33 3.17 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.68 3.83 0.00 1.74 1.87 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.45 7.81 25 D 8.04 4.39 0.00 2.81 2.80 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 26 G 7.64 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.93 4.25 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 T 8.35 4.98 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 1.16 0.00 0.00 29 T 8.80 4.56 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 30 H 10.16 5.08 0.00 3.18 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.55 5.07 0.00 2.98 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 32 C 9.09 4.33 0.00 3.16 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.78 4.73 0.00 4.07 4.04 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 0.00 0.00 0.00 0.00 34 S 8.55 4.81 0.00 4.00 4.12 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 0.00 0.00 0.00 0.00 35 K 8.10 3.76 0.00 1.78 1.89 0.00 1.43 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.21 0.00 0.00 0.00 0.00 1.54 1.35 7.81 36 C 7.88 4.43 0.00 3.40 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.83 2.66 0.00 1.80 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 1.47 2.31 0.00 38 N 8.13 4.30 0.00 2.77 2.81 0.00 0.00 7.17 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.98 4.58 0.00 3.25 3.20 0.00 0.00 6.73 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.00 4.02 1.14 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 41 D 7.94 4.15 0.00 2.53 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.36 4.07 0.00 1.86 1.75 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.81 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 44 R 7.64 4.33 0.00 2.15 2.00 0.00 3.30 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 45 E 8.45 4.67 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 46 A 8.26 3.53 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.71 3.87 0.00 1.74 1.92 0.00 3.13 0.00 0.00 3.17 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 48 N 8.47 4.69 0.00 2.72 2.83 0.00 0.00 6.85 7.76 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 49 L 7.18 4.67 0.00 1.24 1.06 1.29 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.84 4.05 0.00 2.04 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 0.00 2.31 2.31 0.00 51 W 7.84 4.46 0.00 3.62 3.25 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 0.00 52 T 6.65 3.62 3.95 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 0.00 0.00 0.00 0.85 0.00 0.00 53 D 8.65 4.30 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.93 3.84 3.95 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 0.00 0.00 0.00 1.04 0.00 0.00 55 A 7.68 3.99 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 56 R 7.91 4.09 0.00 1.89 1.82 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00