NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0059 8.3549 109.7393 45.5329 0.0000 173.0575 2 S 4.5976 8.2577 120.6050 55.3532 67.1804 173.5616 3 F 4.3122 8.9884 125.4359 60.9499 40.2026 175.3811 4 T 3.4967 7.9655 110.8837 61.2923 69.1054 170.6887 5 M 4.7483 7.7339 118.5852 54.2084 32.9306 175.1002 6 P 4.4631 0.0000 0.0000 64.0938 31.6445 176.9251 7 G 3.9188 7.8257 107.3996 46.1850 0.0000 173.5578 8 L 4.5418 7.4113 119.7210 54.8259 42.3589 175.5234 9 V 4.3282 8.0867 113.3578 60.3731 33.7520 177.0533 10 D 3.9383 8.1588 119.9705 55.2885 40.7007 171.2176 11 S 4.5135 8.0555 110.2192 57.4299 65.3020 173.8744 12 N 4.7330 8.3467 120.0286 51.5650 39.2607 173.6697 13 P 4.3677 0.0000 0.0000 62.6293 31.9450 176.0217 14 A 4.6398 8.1044 124.5046 49.8116 22.0172 173.7172 15 P 4.4979 0.0000 0.0000 61.8166 32.5286 175.6670 16 P 4.4674 0.0000 0.0000 61.8160 29.2783 175.8250 17 E 4.1657 8.0740 118.3593 57.3677 30.4789 173.3659 18 S 4.7388 8.0519 118.8249 56.2287 65.4752 173.4556 19 Q 4.0633 8.6453 122.1907 56.7517 27.9196 176.4563 20 E 4.7892 8.4592 121.6731 55.3584 30.4351 175.7859 21 K 4.5443 8.0735 117.8958 55.9057 36.0526 176.7688 22 K 4.6611 8.3487 126.3813 54.7171 32.3142 174.2000 23 P 4.3916 0.0000 0.0000 62.3276 32.4381 176.4908 24 L 4.1641 8.3141 120.3740 54.9893 41.7715 177.8745 25 K 4.6365 8.1749 124.3692 53.8041 32.4687 174.3004 26 P 4.4141 0.0000 0.0000 62.8547 32.5575 176.7461 27 C 4.6845 7.8723 115.2843 58.5601 31.6230 173.8445 28 C 4.7913 8.6249 119.5624 60.0485 29.5963 175.4912 29 A 4.2228 8.1072 123.6705 53.6370 16.5915 179.1712 30 C 4.3651 8.1215 122.6611 55.7794 39.1976 173.1842 31 P 4.1545 0.0000 0.0000 66.3577 30.9458 177.1523 32 E 3.9019 8.2771 117.8290 59.0862 29.1408 179.1627 33 T 3.3844 7.6670 110.2102 63.9928 69.1781 175.9098 34 K 3.7354 7.7979 123.5119 58.9529 32.1011 178.4675 35 K 3.9011 8.2772 119.3470 59.4841 31.9450 178.6892 36 A 4.0811 7.7660 119.9825 55.0982 18.6509 178.8907 37 R 3.9719 8.3824 117.5262 60.3175 30.0518 178.2677 38 D 4.3682 8.3108 117.7815 57.3244 39.9480 178.5824 39 A 4.0264 7.6503 119.8319 55.5247 18.1970 178.9735 40 C 4.2973 8.1582 116.3390 59.9338 41.5848 175.7969 41 I 3.6210 7.7562 120.9314 64.4665 36.4785 178.0150 42 I 3.6863 8.0006 120.1748 64.0299 36.9815 177.0766 43 E 4.3621 7.3594 114.8793 57.6659 30.3210 176.4408 44 K 4.4648 9.6227 115.1457 57.1936 34.2373 176.0207 45 G 4.4935 7.5212 103.5564 42.2560 0.0000 173.8833 46 E 3.9641 8.5916 120.6165 59.1099 29.5942 179.5820 47 E 4.0097 8.1527 115.3706 58.5130 29.7489 176.9640 48 H 4.9009 8.0816 114.7547 56.0366 29.9778 174.1437 49 C 5.0151 8.1830 117.3398 56.0368 40.1945 175.3514 50 G 3.8497 8.2648 105.6017 45.2812 0.0000 175.4719 51 H 4.2382 8.2139 118.1216 58.7948 27.3057 177.4842 52 L 3.8214 7.2755 120.8812 57.3277 41.4053 178.6987 53 I 3.6911 7.8528 120.7943 63.8218 37.1593 177.7874 54 E 3.9083 8.7623 119.1385 59.5895 29.3330 179.3920 55 A 3.9508 7.7686 119.2422 55.8712 18.7456 179.2278 56 H 4.4407 7.5406 114.3219 58.4417 28.8005 177.7962 57 K 3.8535 8.6101 122.1142 59.4438 31.9547 177.9164 58 E 3.8746 7.9790 119.1372 59.8167 29.2253 178.2455 59 C 4.2124 7.7619 116.5321 59.8819 44.1813 175.1900 60 M 3.4930 7.7853 119.7388 58.1433 31.6588 178.3024 61 R 4.0511 7.9875 118.6210 59.6282 29.9421 178.0066 62 A 3.9485 7.7631 119.2218 55.4923 18.3434 179.2786 63 L 4.0686 7.4253 115.6653 55.9752 41.6083 178.3734 64 G 3.9921 8.0061 106.8893 45.3694 0.0000 173.6804 65 F 4.5875 7.9905 117.3631 57.3966 40.1022 175.9772 66 K 4.4935 8.3895 122.2405 55.4531 30.9000 177.0088 67 I 4.0885 7.4166 122.7534 61.4302 37.2922 176.3838 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 4.01 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 0.00 0.00 0.00 2 S 8.26 4.60 0.00 3.92 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 3 F 8.99 4.31 0.00 2.88 3.12 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 4 T 7.97 3.50 4.15 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 1.23 0.00 0.00 5 M 7.73 4.75 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 6 P 0.00 4.46 0.00 2.13 2.11 0.00 3.58 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.87 0.00 7 G 7.83 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.41 4.54 0.00 1.65 1.63 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.09 4.33 2.08 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 0.84 0.00 0.00 0.93 0.00 0.00 10 D 8.16 3.94 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 4.51 0.00 3.83 3.69 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 12 N 8.35 4.73 0.00 2.74 2.73 0.00 0.00 6.92 8.02 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 13 P 0.00 4.37 0.00 2.04 1.99 0.00 3.68 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 2.03 2.08 0.00 14 A 8.10 4.64 1.19 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 0.00 0.00 15 P 0.00 4.50 0.00 2.34 2.09 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 16 P 0.00 4.47 0.00 2.20 2.14 0.00 3.79 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 17 E 8.07 4.17 0.00 2.11 2.13 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 2.15 2.30 0.00 18 S 8.05 4.74 0.00 3.87 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 19 Q 8.65 4.06 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.51 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 20 E 8.46 4.79 0.00 2.01 1.95 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 2.30 2.30 0.00 21 K 8.07 4.54 0.00 1.70 1.70 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.35 7.81 22 K 8.35 4.66 0.00 1.64 1.67 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.40 7.81 23 P 0.00 4.39 0.00 2.22 2.04 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 24 L 8.31 4.16 0.00 1.64 1.68 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.17 4.64 0.00 1.69 1.71 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.33 7.81 26 P 0.00 4.41 0.00 2.18 2.07 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 27 C 7.87 4.68 0.00 3.08 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 28 C 8.62 4.79 0.00 2.93 2.90 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 29 A 8.11 4.22 1.45 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 0.00 0.00 0.00 30 C 8.12 4.37 0.00 3.02 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 31 P 0.00 4.15 0.00 2.24 2.34 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 32 E 8.28 3.90 0.00 2.17 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 0.00 2.35 2.37 0.00 33 T 7.67 3.38 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 1.19 0.00 0.00 34 K 7.80 3.74 0.00 1.87 2.17 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.65 7.81 35 K 8.28 3.90 0.00 2.00 1.82 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.49 7.81 36 A 7.77 4.08 1.39 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 0.00 0.00 0.00 37 R 8.38 3.97 0.00 2.02 2.08 0.00 3.29 0.00 0.00 3.20 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.04 0.00 38 D 8.31 4.37 0.00 2.92 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.65 4.03 1.38 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 40 C 8.16 4.30 0.00 3.05 3.27 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 41 I 7.76 3.62 2.01 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 1.65 0.69 0.97 0.00 0.00 42 I 8.00 3.69 2.15 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 1.41 0.61 0.92 0.00 0.00 43 E 7.36 4.36 0.00 2.15 1.96 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 2.25 2.48 0.00 44 K 9.62 4.46 0.00 1.78 1.81 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.43 7.81 45 G 7.52 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.59 3.96 0.00 2.08 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 2.41 2.37 0.00 47 E 8.15 4.01 0.00 1.96 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 2.15 1.79 0.00 48 H 8.08 4.90 0.00 3.30 3.39 0.00 5.61 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 8.18 5.02 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 50 G 8.26 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 0.00 0.00 0.00 51 H 8.21 4.24 0.00 3.35 3.54 0.00 5.46 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.28 3.82 0.00 1.59 1.70 1.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.85 3.69 2.02 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 1.53 0.81 0.92 0.00 0.00 54 E 8.76 3.91 0.00 1.93 2.01 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 2.52 2.49 0.00 55 A 7.77 3.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.54 4.44 0.00 3.54 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.61 3.85 0.00 1.94 1.92 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.48 7.81 58 E 7.98 3.87 0.00 2.16 1.94 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 2.30 2.49 0.00 59 C 7.76 4.21 0.00 3.00 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 60 M 7.79 3.49 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.84 0.00 61 R 7.99 4.05 0.00 2.00 2.09 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 62 A 7.76 3.95 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 63 L 7.43 4.07 0.00 1.04 1.51 0.10 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.01 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 65 F 7.99 4.59 0.00 2.86 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 66 K 8.39 4.49 0.00 1.75 1.78 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.42 7.81 67 I 7.42 4.09 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.48 0.98 0.00 0.00