NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 G 3.7141 8.3393 109.7449 45.2388 0.0000 174.0085 6 S 4.1386 8.3727 116.5213 57.2743 65.0147 172.4447 7 P 4.2799 0.0000 0.0000 66.3007 31.4892 180.0247 8 E 3.9876 8.1608 116.5129 59.2188 29.4550 178.9086 9 F 4.0514 8.4271 120.8400 61.5031 39.5236 177.0678 10 E 3.9918 8.9926 118.4712 59.3378 29.1627 179.3096 11 E 3.9498 8.1038 118.7357 59.5006 29.4892 179.3302 12 Q 3.9148 8.0923 118.0723 58.9456 28.7852 178.6658 13 E 3.7535 8.0071 119.4011 59.2728 29.3274 179.3430 14 A 3.9496 7.9214 120.6379 55.2677 18.4816 179.8187 15 I 3.6588 7.8603 118.3711 64.7251 37.0928 178.4487 16 M 4.0262 8.3430 119.9669 58.5026 31.7687 179.0117 17 K 4.1133 7.9942 118.4103 59.3039 32.0845 179.6498 18 V 3.5800 7.4851 118.7666 65.9341 31.4185 178.0180 19 L 3.9782 7.9957 118.7378 57.9636 41.3765 179.5688 20 Q 3.9784 8.2887 117.9881 59.0537 28.5737 179.1050 21 R 3.8959 8.0937 119.0455 59.2248 30.0441 178.6136 22 D 4.2687 8.4976 117.9807 57.2371 41.2608 178.0785 23 A 3.9673 8.2472 121.1933 55.0977 18.3731 179.3248 24 A 3.9368 8.1910 119.4020 55.3031 18.3934 179.6414 25 L 3.8858 8.1635 118.9206 58.2579 42.1415 179.1813 26 K 3.9224 8.4204 118.8497 59.7773 31.9427 179.5212 27 R 3.9690 8.2081 117.8464 58.7924 29.9888 178.9591 28 A 4.0076 8.0552 121.0209 55.0428 18.3068 179.2759 29 E 3.9214 8.4575 118.0669 59.3617 29.7143 178.8277 30 E 3.9440 8.3980 118.8036 59.4099 29.3226 178.9404 31 E 3.9258 7.7701 117.7400 59.1689 30.0875 178.4222 32 R 4.0737 8.0493 118.7105 59.6594 30.2664 178.6530 33 V 3.6457 8.0534 118.0480 66.0926 31.2487 178.0766 34 R 3.9464 7.9101 116.9942 58.8864 30.2247 177.6412 35 H 4.7684 7.9485 113.6261 55.6335 29.0185 176.7866 36 L 4.0352 7.6920 122.7852 57.5648 41.2961 177.5959 37 P 4.2673 0.0000 0.0000 65.2215 31.3241 177.9763 38 E 4.1901 8.0115 115.8975 57.9530 29.4765 177.5098 39 K 4.5013 7.9189 116.7982 56.2621 34.4777 176.3132 40 I 4.6837 7.9374 110.6938 58.9491 40.2492 175.1992 41 K 4.2288 8.5723 121.3055 58.1199 33.3711 177.5559 42 D 4.3543 8.0295 118.3189 54.6540 41.9164 176.4564 43 D 4.3615 8.7731 127.0222 57.6084 40.9155 178.5910 44 Q 3.9627 8.1534 119.4515 59.2641 29.2076 177.8260 45 Q 3.9961 8.2532 118.9382 59.0563 28.7383 179.0629 46 L 4.0190 8.1339 119.8211 57.8175 41.6200 179.7017 47 K 4.0663 8.2810 118.4425 59.5198 31.9678 179.2624 48 N 4.4937 8.5408 116.8594 56.8810 38.3927 177.6190 49 M 4.2320 8.4641 119.1062 58.1185 32.1249 178.3968 50 S 4.4396 8.2476 112.7426 59.0232 63.7658 175.3218 51 G 4.0948 8.3424 111.5848 45.6903 0.0000 175.0935 52 Q 4.2530 7.9735 120.7954 58.0291 29.1680 177.3360 53 W 4.4531 8.4057 113.7858 58.7113 28.5155 176.8937 54 F 3.3498 7.5889 121.1997 58.5037 39.0129 174.7436 55 Y 4.1426 7.4877 121.5744 58.5041 37.9061 170.2005 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 5 G 8.34 3.71 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 0.00 0.00 0.00 6 S 8.37 4.14 0.00 4.18 4.03 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 7 P 0.00 4.28 0.00 2.20 2.19 0.00 3.62 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 2.14 2.23 0.00 8 E 8.16 3.99 0.00 2.11 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 2.42 2.44 0.00 9 F 8.43 4.05 0.00 3.16 3.31 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 0.00 0.00 0.00 0.00 10 E 8.99 3.99 0.00 2.17 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 2.75 2.59 0.00 11 E 8.10 3.95 0.00 2.22 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 0.00 2.33 2.56 0.00 12 Q 8.09 3.91 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 13 E 8.01 3.75 0.00 1.99 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 0.00 1.58 1.99 0.00 14 A 7.92 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.86 3.66 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.88 0.89 0.00 0.00 16 M 8.34 4.03 0.00 1.94 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.80 0.00 17 K 7.99 4.11 0.00 2.00 1.84 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.51 7.81 18 V 7.49 3.58 2.21 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 1.11 0.00 0.00 0.92 0.00 0.00 19 L 8.00 3.98 0.00 1.90 1.69 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.29 3.98 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 21 R 8.09 3.90 0.00 2.04 1.97 0.00 3.12 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 22 D 8.50 4.27 0.00 2.76 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 23 A 8.25 3.97 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 24 A 8.19 3.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.16 3.89 0.00 1.85 1.86 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.42 3.92 0.00 1.99 1.86 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.67 7.81 27 R 8.21 3.97 0.00 1.84 1.97 0.00 3.29 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 28 A 8.06 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.46 3.92 0.00 2.10 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 2.33 2.42 0.00 30 E 8.40 3.94 0.00 2.21 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 0.00 2.33 2.51 0.00 31 E 7.77 3.93 0.00 1.94 2.18 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 2.36 2.43 0.00 32 R 8.05 4.07 0.00 1.96 2.12 0.00 3.17 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 33 V 8.05 3.65 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.04 0.00 0.00 34 R 7.91 3.95 0.00 1.89 1.83 0.00 3.15 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 35 H 7.95 4.77 0.00 3.22 3.40 0.00 5.63 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.69 4.04 0.00 1.88 1.75 0.96 1.00 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 37 P 0.00 4.27 0.00 2.03 2.13 0.00 3.75 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 2.03 2.19 0.00 38 E 8.01 4.19 0.00 2.17 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 2.37 2.38 0.00 39 K 7.92 4.50 0.00 1.73 1.83 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.40 7.81 40 I 7.94 4.68 1.88 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 1.49 0.68 0.92 0.00 0.00 41 K 8.57 4.23 0.00 1.76 1.90 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.41 7.81 42 D 8.03 4.35 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.77 4.36 0.00 2.77 2.72 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 44 Q 8.15 3.96 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 45 Q 8.25 4.00 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 46 L 8.13 4.02 0.00 1.93 1.75 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.28 4.07 0.00 2.04 1.98 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.74 7.81 48 N 8.54 4.49 0.00 2.85 2.77 0.00 0.00 7.05 8.49 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 49 M 8.46 4.23 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.57 0.00 50 S 8.25 4.44 0.00 4.09 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 51 G 8.34 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 52 Q 7.97 4.25 0.00 2.10 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 53 W 8.41 4.45 0.00 3.67 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 54 F 7.59 3.35 0.00 1.51 2.18 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 55 Y 7.49 4.14 0.00 3.16 2.76 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