NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 54 P 4.3250 0.0000 0.0000 61.7994 32.4948 176.8581 55 P 4.2304 0.0000 0.0000 62.1430 29.9402 174.1592 56 G 3.9628 8.2766 113.8477 44.5470 0.0000 168.3399 57 L 3.4795 8.1245 122.1262 55.1979 43.1137 174.9964 58 C 3.8564 8.4897 129.6485 58.8091 32.0478 172.4507 59 P 4.4392 0.0000 0.0000 63.6420 31.0848 177.7305 60 R 4.1972 7.3000 119.2740 58.5234 30.9008 178.1504 61 C 4.1869 7.8959 113.8947 58.8696 30.6966 173.6601 62 K 3.8234 7.9806 119.4331 57.5377 30.2716 175.4604 63 K 4.5206 7.9906 112.2470 54.7461 34.4458 176.2895 64 G 3.8965 7.0650 108.4440 45.8041 0.0000 171.7606 65 Y 4.6834 8.3666 117.7384 56.8548 38.5620 175.2135 66 H 4.5142 8.0407 119.9568 53.8508 31.6453 174.5896 67 W 4.3924 8.1851 119.9767 55.6586 29.7267 177.4718 68 K 3.9396 8.9248 122.1908 60.7948 31.6416 179.3585 69 S 4.3399 8.2518 112.4029 60.1082 62.4724 174.7577 70 E 4.5166 7.4846 119.2308 55.7100 29.6779 175.7043 71 C 3.7672 7.7975 120.5865 59.8165 31.5536 172.9721 72 K 4.4184 8.2217 125.1746 56.5695 32.6599 176.6024 73 S 4.3821 7.6190 115.3976 58.6194 63.7736 174.1858 74 K 3.9733 8.6350 122.7485 58.4663 32.3220 176.5222 75 F 5.4437 7.9144 114.1666 55.6993 42.8345 172.8282 76 D 4.9222 9.1257 120.7240 51.1897 42.1729 174.3340 77 K 4.0025 8.2659 119.3480 57.4539 32.7779 175.9884 78 D 4.3550 9.3442 121.1068 54.1416 39.8614 173.4676 79 G 3.9418 7.5457 103.2794 46.6394 0.0000 174.1520 80 N 4.7115 8.1342 116.1058 51.5243 39.6916 173.5480 81 P 4.3175 0.0000 0.0000 62.3062 31.6930 174.7170 82 L 4.0162 8.2823 127.6941 53.6175 41.6610 175.9049 83 P 4.5959 0.0000 0.0000 61.3045 32.7488 174.8353 84 P 4.3939 0.0000 0.0000 63.1713 31.4468 176.1694 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 54 P 0.00 4.32 0.00 2.24 2.18 0.00 3.80 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 2.02 2.08 0.00 55 P 0.00 4.23 0.00 2.27 2.07 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 56 G 8.28 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 0.00 0.00 0.00 57 L 8.12 3.48 0.00 1.24 1.39 -0.15 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.49 3.86 0.00 2.64 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 59 P 0.00 4.44 0.00 2.16 2.06 0.00 3.70 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.87 0.00 60 R 7.30 4.20 0.00 1.95 1.94 0.00 3.17 0.00 0.00 3.41 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 61 C 7.90 4.19 0.00 3.19 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 62 K 7.98 3.82 0.00 1.85 1.84 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.24 1.41 7.81 63 K 7.99 4.52 0.00 1.73 1.74 0.00 2.04 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.38 7.81 64 G 7.07 3.90 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 0.00 0.00 0.00 65 Y 8.37 4.68 0.00 2.94 2.85 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 66 H 8.04 4.51 0.00 3.30 3.34 0.00 5.55 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 W 8.19 4.39 0.00 3.41 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 68 K 8.92 3.94 0.00 2.04 2.16 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.72 1.63 7.81 69 S 8.25 4.34 0.00 3.93 3.98 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 70 E 7.48 4.52 0.00 2.59 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 0.00 2.36 2.42 0.00 71 C 7.80 3.77 0.00 3.02 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 72 K 8.22 4.42 0.00 1.86 1.83 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 1.41 7.81 73 S 7.62 4.38 0.00 3.91 3.98 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 74 K 8.64 3.97 0.00 1.80 1.87 0.00 1.72 0.00 0.00 1.91 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.10 1.33 7.81 75 F 7.91 5.44 0.00 3.01 2.85 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 76 D 9.13 4.92 0.00 2.84 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 77 K 8.27 4.00 0.00 1.98 1.76 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.56 7.81 78 D 9.34 4.35 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.55 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 80 N 8.13 4.71 0.00 3.25 2.79 0.00 0.00 7.15 7.62 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 81 P 0.00 4.32 0.00 1.96 1.97 0.00 3.86 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 82 L 8.28 4.02 0.00 1.57 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.60 0.00 2.07 2.03 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 84 P 0.00 4.39 0.00 2.19 2.05 0.00 3.78 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 1.97 1.94 0.00