NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9887 8.3549 109.7365 45.4350 0.0000 173.2346 2 S 4.4397 8.4463 118.4538 55.6898 66.5195 171.7392 3 S 4.7447 9.2476 118.4909 56.6172 65.8053 171.2240 4 G 3.3783 7.9140 110.3169 44.8703 0.0000 173.2585 5 S 4.3609 7.5781 113.2699 57.5133 65.4678 173.8162 6 S 4.3601 8.6126 115.5851 57.3376 62.0551 169.8962 7 G 3.9135 8.7468 124.1555 44.4277 0.0000 172.3324 8 S 3.9939 8.7034 117.8829 58.6086 62.3758 173.8332 9 S 4.5639 8.3930 124.4300 56.3520 64.2104 173.9039 10 S 4.3476 8.5452 120.7258 57.7654 63.6866 173.9371 11 S 4.8647 8.4058 117.2255 56.8883 65.6548 173.1885 12 C 4.5374 8.4100 117.6252 61.4107 29.6126 175.4058 13 T 3.9396 7.6670 114.4446 63.4104 68.5779 173.8231 14 V 3.8485 8.1263 124.5250 62.2155 31.8404 176.0119 15 T 4.0085 8.4204 122.3986 63.1203 67.9095 173.1965 16 T 3.3756 8.4836 114.3568 61.1795 67.5714 172.9030 17 G 4.7399 7.4240 118.0563 47.1497 0.0000 172.4321 18 T 4.5766 8.2551 116.6339 59.1308 70.7948 173.6458 19 L 4.9014 8.3301 123.2871 53.7446 43.6095 175.3784 20 G 4.1811 7.8784 105.9242 44.7604 0.0000 171.7702 21 F 3.9218 8.9701 121.3237 58.4044 37.7640 176.4929 22 G 4.0444 8.4882 109.9087 47.8676 0.0000 173.1220 23 D 4.7427 7.4061 116.0607 50.6866 42.4879 174.9510 24 K 3.9210 7.8025 118.2733 55.4023 33.1943 176.8887 25 F 4.4897 8.6029 118.4585 55.4222 41.6454 175.1354 26 K 4.1922 8.8472 126.3882 56.4247 31.9363 176.7990 27 R 4.7391 8.3048 120.1215 53.2448 32.4031 173.3950 28 P 4.5351 0.0000 0.0000 62.6541 32.1203 176.6300 29 I 3.8485 8.2334 119.7292 64.4686 36.7929 177.9443 30 G 3.6163 7.5165 108.6148 48.7864 0.0000 174.9967 31 S 4.7089 7.7576 117.0064 57.5221 63.1508 172.9306 32 W 5.1757 8.0052 116.2428 54.9351 31.3265 173.9060 33 E 4.3883 8.9793 124.7971 55.1754 29.8651 175.3412 34 C 4.2972 8.1703 127.2405 60.2797 32.4644 173.8958 35 S 4.4167 8.5733 113.8910 59.5041 64.1057 175.5537 36 V 3.8337 8.0178 112.6693 63.6450 31.4709 176.5364 37 C 4.6258 7.8352 111.3056 56.9729 31.6028 173.1467 38 C 4.5726 7.9618 115.6646 60.4756 24.5754 172.6349 39 V 4.4201 7.1726 117.7782 60.7520 34.1902 175.1749 40 S 4.1478 8.5534 122.0828 59.3671 63.3906 173.0826 41 N 4.7777 7.6102 119.6983 51.7373 43.1815 173.0197 42 N 4.8674 8.3654 116.2103 51.8302 40.1359 175.9381 43 A 4.3578 9.2974 128.0633 55.5296 18.6419 178.3387 44 E 4.0717 8.3863 111.7194 59.3306 29.7311 177.1570 45 D 4.4159 8.3599 121.0354 54.7133 41.0260 175.5950 46 N 4.7844 8.8784 122.6916 53.5928 39.8732 173.8282 47 K 5.1947 7.9506 115.2775 55.4803 37.2483 174.7313 48 C 4.4933 8.9734 122.6538 59.0539 32.9699 174.1374 49 V 4.2325 8.1714 112.4628 61.9538 33.6241 177.5507 50 S 4.3088 8.1677 113.5804 60.1431 62.4889 174.1445 51 C 4.6314 7.8275 111.6194 57.0446 31.4353 173.0696 52 M 3.7300 8.2373 118.0494 55.9188 28.8690 176.3177 53 S 4.9834 7.7087 112.6691 56.1993 66.0820 174.0633 54 E 4.3842 8.8632 120.8523 56.7013 29.7076 176.6212 55 K 3.5301 8.3876 125.7470 55.2750 32.7632 174.8018 56 P 4.1330 0.0000 0.0000 63.6822 32.0946 176.4924 57 G 3.9387 8.5834 109.6378 45.8535 0.0000 173.0392 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 S 8.45 4.44 0.00 3.89 3.72 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 0.00 0.00 0.00 0.00 3 S 9.25 4.74 0.00 3.79 3.72 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 0.00 0.00 0.00 0.00 4 G 7.91 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.58 4.36 0.00 3.94 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 6 S 8.61 4.36 0.00 3.84 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 7 G 8.75 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 0.00 0.00 0.00 8 S 8.70 3.99 0.00 3.84 3.82 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 0.00 0.00 0.00 9 S 8.39 4.56 0.00 3.85 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.55 4.35 0.00 3.98 3.86 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 11 S 8.41 4.86 0.00 3.96 3.86 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 12 C 8.41 4.54 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.67 3.94 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 1.22 0.00 0.00 14 V 8.13 3.85 2.27 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 0.73 0.00 0.00 0.94 0.00 0.00 15 T 8.42 4.01 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 16 T 8.48 3.38 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 17 G 7.42 4.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.26 4.58 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 19 L 8.33 4.90 0.00 1.75 1.71 0.96 0.33 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 20 G 7.88 4.18 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 0.00 0.00 0.00 21 F 8.97 3.92 0.00 3.11 3.21 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 0.00 0.00 0.00 0.00 22 G 8.49 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 0.00 0.00 0.00 23 D 7.41 4.74 0.00 2.37 2.44 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 24 K 7.80 3.92 0.00 1.63 1.76 0.00 1.50 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.71 7.81 25 F 8.60 4.49 0.00 3.17 3.04 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 26 K 8.85 4.19 0.00 1.77 1.82 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.43 7.81 27 R 8.30 4.74 0.00 1.93 1.95 0.00 3.43 0.00 0.00 3.37 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 28 P 0.00 4.54 0.00 2.23 2.12 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 29 I 8.23 3.85 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.56 0.94 0.00 0.00 30 G 7.52 3.62 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 0.00 0.00 0.00 31 S 7.76 4.71 0.00 3.76 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 32 W 8.01 5.18 0.00 3.46 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 E 8.98 4.39 0.00 2.04 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 2.25 2.31 0.00 34 C 8.17 4.30 0.00 3.20 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 35 S 8.57 4.42 0.00 3.83 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 36 V 8.02 3.83 2.10 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 0.89 0.00 0.00 0.97 0.00 0.00 37 C 7.84 4.63 0.00 3.03 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 38 C 7.96 4.57 0.00 3.16 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 39 V 7.17 4.42 1.98 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 0.92 0.00 0.00 0.96 0.00 0.00 40 S 8.55 4.15 0.00 3.70 3.68 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 41 N 7.61 4.78 0.00 1.44 1.82 0.00 0.00 6.49 7.55 0.00 0.00 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 N 8.37 4.87 0.00 2.79 2.79 0.00 0.00 6.66 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 9.30 4.36 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 4.07 0.00 2.12 2.15 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 2.34 2.40 0.00 45 D 8.36 4.42 0.00 3.23 3.05 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 46 N 8.88 4.78 0.00 2.76 2.75 0.00 0.00 6.91 6.70 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 47 K 7.95 5.19 0.00 1.70 1.76 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.42 7.81 48 C 8.97 4.49 0.00 3.32 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 49 V 8.17 4.23 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 0.71 0.00 0.00 0.87 0.00 0.00 50 S 8.17 4.31 0.00 3.78 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 51 C 7.83 4.63 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.24 3.73 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 53 S 7.71 4.98 0.00 3.94 4.02 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 54 E 8.86 4.38 0.00 1.95 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 2.28 2.31 0.00 55 K 8.39 3.53 0.00 0.85 1.54 0.00 0.89 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.60 0.21 7.81 56 P 0.00 4.13 0.00 2.12 1.98 0.00 3.04 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.97 0.00 57 G 8.58 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