NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 S 4.4233 8.1933 115.4087 58.0406 64.8448 173.9420 35 S 4.4833 7.6708 117.5342 58.2502 63.1754 174.4585 36 G 3.7379 7.7996 111.2664 47.4318 0.0000 176.4910 37 R 3.8979 7.5810 115.6654 58.7245 29.9652 177.3446 38 F 5.0732 7.9136 115.9216 57.0001 39.8684 176.5208 39 G 3.6504 7.4660 110.6328 47.2829 0.0000 174.1641 40 A 4.4770 8.5775 127.4657 52.0825 18.8422 177.1488 41 R 4.1377 7.5410 117.5317 57.1016 31.7644 176.0003 42 Y 4.0594 7.9617 117.1369 57.0327 36.7036 171.3209 43 G 4.0576 8.0161 102.7637 45.4572 0.0000 173.1923 44 R 3.8406 8.1893 116.4863 59.5348 29.8978 178.9744 45 V 3.5404 7.7740 116.5993 66.7123 31.5774 178.1935 46 S 4.1109 8.1624 113.9679 61.9923 62.7927 177.0581 47 R 4.2567 7.9643 117.9900 58.8320 29.3797 178.7188 48 R 3.9303 8.5403 120.5570 59.3886 29.9790 178.6562 49 R 3.9362 8.1498 117.9956 59.1958 30.0102 179.1211 50 V 3.5235 7.8862 117.9128 65.7734 31.4059 178.0101 51 A 4.2285 7.9447 121.8244 54.7163 18.2529 179.2807 52 E 3.8946 8.1829 116.9755 59.7022 29.6089 179.5051 53 I 3.6894 7.9469 119.7737 64.8080 37.2746 178.5153 54 E 4.0904 8.4805 119.2453 58.9930 29.0260 179.4862 55 S 4.0807 8.2225 113.8417 61.4588 62.3382 175.8631 56 E 4.4356 8.2185 120.5549 59.1600 29.3870 178.0800 57 M 4.7738 7.8246 119.3941 58.0603 32.5137 177.2349 58 N 4.7300 8.2159 113.7729 53.3201 39.2406 175.4211 59 E 4.1408 7.0311 118.8709 56.0279 30.2037 176.1935 60 D 4.5525 8.4010 121.1032 54.7721 41.6347 175.5430 61 H 5.0507 8.7728 119.8466 53.6871 32.1810 173.2381 62 A 4.5066 8.6064 124.5557 51.4815 18.8669 176.8709 63 C 4.3179 9.1902 124.6772 59.3674 32.3221 173.0618 64 P 4.2874 0.0000 0.0000 64.2585 30.7203 176.1057 65 N 4.3070 7.0574 115.1498 54.5168 39.7241 175.8750 66 C 4.2089 8.1076 117.4494 60.7911 30.5592 175.5712 67 G 4.1428 8.3213 106.1712 43.7811 0.0000 173.1266 68 E 4.0829 7.8845 119.4428 56.0255 30.8601 176.4226 69 D 5.1480 8.2600 123.4783 52.6278 38.9133 176.2464 70 R 4.7845 7.7048 116.8875 55.7715 33.6184 174.5514 71 V 4.8154 8.1733 119.2271 62.2256 32.7244 174.8596 72 D 5.2926 9.1919 126.6983 52.1595 45.1966 175.3055 73 R 3.3574 8.8175 121.8974 56.4161 30.5318 176.2963 74 Q 4.3418 8.1382 123.7540 56.0034 30.5233 176.0475 75 G 3.7022 6.4655 104.0694 46.1169 0.0000 172.2673 76 T 3.7617 8.5007 120.1545 64.2823 68.1283 174.9711 77 G 4.2469 8.4900 115.0285 46.1642 0.0000 171.3028 78 I 4.5886 6.6234 120.1366 59.1590 39.3386 174.8944 79 W 5.1185 8.4636 126.0063 55.0121 33.3416 174.1959 80 Q 5.7732 8.7566 122.1904 55.3851 32.7905 172.7556 81 C 5.1699 9.0383 126.8438 58.7751 32.4272 174.3980 82 S 4.3326 9.1518 121.5095 60.6154 62.5713 174.4374 83 Y 4.4841 7.6298 122.8750 59.0276 39.0632 175.0894 84 C 4.1032 7.9006 114.8906 57.6282 30.7115 173.9996 85 D 4.6037 8.2549 119.2465 54.9551 38.6509 172.9226 86 Y 4.3885 7.9954 121.3968 58.1622 39.6863 174.4334 87 K 5.1562 8.5737 129.1794 54.9305 33.6778 175.1768 88 F 5.0059 9.1204 122.0719 55.6947 41.9551 173.4478 89 T 4.7541 8.4597 109.3258 61.1409 70.4718 173.9933 90 G 4.2770 7.8292 108.5287 46.0080 0.0000 172.9842 91 G 4.0881 7.7897 107.0836 46.4694 0.0000 175.3115 92 S 4.1417 8.6845 116.4664 60.7692 62.9322 175.1831 93 Y 5.0748 7.7942 114.7113 57.2053 39.9888 175.1147 94 K 4.5565 7.9210 119.0369 53.3981 35.7796 175.3992 95 P 2.9700 0.0000 0.0000 64.1087 31.5035 176.1138 96 E 4.8505 7.6006 117.1073 54.0211 32.7265 175.5271 97 T 4.6849 8.0172 112.5497 59.2172 72.6601 173.5714 98 P 4.3551 0.0000 0.0000 65.8969 31.5848 178.9498 99 G 3.8306 8.1139 104.2581 47.5661 0.0000 175.9752 100 G 3.6676 8.1144 108.1072 47.4388 0.0000 175.4561 101 K 4.2442 8.0233 118.2371 58.0183 32.3445 178.6028 102 T 4.2134 7.6025 116.6584 65.6419 68.6303 176.8353 103 V 3.6931 7.3289 119.5980 66.1167 31.6344 177.5249 104 R 4.0561 7.9348 117.6516 59.1666 30.2486 177.7636 105 R 3.9878 7.9949 116.0555 58.8111 30.3609 176.8081 106 S 4.3873 7.5487 114.5203 58.2565 63.1834 173.7323 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 34 S 8.19 4.42 0.00 3.97 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 35 S 7.67 4.48 0.00 4.05 4.09 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 0.00 0.00 0.00 0.00 36 G 7.80 3.74 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 37 R 7.58 3.90 0.00 1.82 1.93 0.00 2.76 0.00 0.00 3.00 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.78 0.00 38 F 7.91 5.07 0.00 3.45 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 39 G 7.47 3.65 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 0.00 0.00 0.00 40 A 8.58 4.48 1.24 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 0.00 0.00 0.00 41 R 7.54 4.14 0.00 0.99 0.66 0.00 2.82 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.35 0.00 42 Y 7.96 4.06 0.00 3.07 2.99 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 43 G 8.02 4.06 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 0.00 0.00 0.00 44 R 8.19 3.84 0.00 1.88 1.97 0.00 3.18 0.00 0.00 3.27 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 45 V 7.77 3.54 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 1.07 0.00 0.00 0.94 0.00 0.00 46 S 8.16 4.11 0.00 4.03 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 47 R 7.96 4.26 0.00 2.23 2.50 0.00 2.92 0.00 0.00 3.28 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.73 0.00 48 R 8.54 3.93 0.00 1.94 2.17 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 49 R 8.15 3.94 0.00 2.05 1.93 0.00 3.17 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 50 V 7.89 3.52 2.26 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 1.22 0.00 0.00 1.06 0.00 0.00 51 A 7.94 4.23 1.44 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 0.00 0.00 52 E 8.18 3.89 0.00 2.18 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 2.34 2.55 0.00 53 I 7.95 3.69 1.79 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 1.47 0.70 0.57 0.00 0.00 54 E 8.48 4.09 0.00 2.06 1.99 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 2.30 2.47 0.00 55 S 8.22 4.08 0.00 4.01 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 56 E 8.22 4.44 0.00 2.04 2.03 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 2.39 2.53 0.00 57 M 7.82 4.77 0.00 2.36 2.43 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.08 2.62 0.00 58 N 8.22 4.73 0.00 2.79 2.89 0.00 0.00 7.09 7.15 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 59 E 7.03 4.14 0.00 2.04 1.80 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 2.34 2.62 0.00 60 D 8.40 4.55 0.00 2.53 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.77 5.05 0.00 3.11 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.61 4.51 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 63 C 9.19 4.32 0.00 3.14 2.99 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 64 P 0.00 4.29 0.00 1.85 1.94 0.00 3.51 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 1.30 1.92 0.00 65 N 7.06 4.31 0.00 2.42 2.50 0.00 0.00 6.98 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 C 8.11 4.21 0.00 3.35 3.26 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 0.00 67 G 8.32 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 68 E 7.88 4.08 0.00 1.96 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 1.85 2.20 0.00 69 D 8.26 5.15 0.00 2.55 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.70 4.78 0.00 1.81 1.96 0.00 3.00 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 71 V 8.17 4.82 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 1.15 0.00 0.00 1.24 0.00 0.00 72 D 9.19 5.29 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.82 3.36 0.00 1.30 1.57 0.00 3.03 0.00 0.00 3.03 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 74 Q 8.14 4.34 0.00 1.78 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.54 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 75 G 6.47 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 76 T 8.50 3.76 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 1.05 0.00 0.00 77 G 8.49 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 0.00 0.00 0.00 0.00 78 I 6.62 4.59 1.64 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.93 0.71 0.00 0.00 79 W 8.46 5.12 0.00 1.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.76 5.77 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 81 C 9.04 5.17 0.00 3.31 3.09 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 0.00 0.00 0.00 0.00 82 S 9.15 4.33 0.00 4.10 4.06 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 83 Y 7.63 4.48 0.00 2.91 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 84 C 7.90 4.10 0.00 2.99 2.81 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 0.00 0.00 0.00 0.00 85 D 8.25 4.60 0.00 2.92 2.91 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 86 Y 8.00 4.39 0.00 3.02 2.98 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 87 K 8.57 5.16 0.00 1.81 1.66 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.38 7.81 88 F 9.12 5.01 0.00 2.96 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.46 4.75 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 90 G 7.83 4.28 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 0.00 91 G 7.79 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.68 4.14 0.00 2.98 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 7.79 5.07 0.00 3.17 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 94 K 7.92 4.56 0.00 1.79 1.52 0.00 1.79 0.00 0.00 1.97 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.49 7.81 95 P 0.00 2.97 0.00 1.81 0.96 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.28 0.00 96 E 7.60 4.85 0.00 1.85 1.81 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 0.00 2.19 2.21 0.00 97 T 8.02 4.68 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 98 P 0.00 4.36 0.00 2.05 2.17 0.00 3.69 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 2.04 2.17 0.00 99 G 8.11 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 0.00 0.00 0.00 100 G 8.11 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 0.00 0.00 0.00 101 K 8.02 4.24 0.00 1.75 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.61 7.81 102 T 7.60 4.21 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 103 V 7.33 3.69 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 0.76 0.00 0.00 1.01 0.00 0.00 104 R 7.93 4.06 0.00 1.84 1.96 0.00 3.30 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 105 R 7.99 3.99 0.00 1.93 2.04 0.00 3.19 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 106 S 7.55 4.39 0.00 4.02 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