NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 P 4.5238 0.0000 0.0000 62.9711 32.5972 174.4260 18 C 5.0322 8.4218 114.6798 53.2350 42.0777 172.5404 19 C 5.1456 10.1533 121.6857 55.4370 47.1323 175.8321 20 D 4.2462 9.7253 127.7769 56.0560 41.1018 176.2799 21 R 4.5342 8.6735 118.8051 54.4405 32.1156 173.6804 22 C 5.4751 8.7173 123.5936 54.6115 45.3850 172.7051 23 E 5.0014 9.1254 124.5743 54.8273 33.2404 174.1618 24 C 5.5996 8.5829 118.8517 55.0185 44.2545 174.1016 25 T 4.1498 8.9107 112.6315 61.4396 69.4377 173.9223 26 K 4.5166 8.3669 119.9257 56.4955 32.6594 176.7469 27 S 4.6796 7.7981 113.2624 56.7981 65.3912 172.2800 28 I 4.5942 7.8695 120.8252 58.5084 38.9091 174.3794 29 P 4.4844 0.0000 0.0000 61.5427 32.1987 174.2827 30 P 4.5989 0.0000 0.0000 62.7343 32.8718 174.9356 31 Q 4.8099 8.9005 121.2409 54.6172 30.9563 173.9642 32 C 5.5177 9.3666 121.8967 55.0899 45.2160 173.2950 33 R 5.0979 8.9147 121.2791 54.7668 33.8721 172.9074 34 C 5.1808 8.9119 124.7830 55.7157 44.3085 173.0142 35 S 4.6488 9.1285 120.9695 58.1273 63.5158 174.2868 36 D 4.3830 8.1925 120.6660 55.2146 41.0479 175.5721 37 V 4.7178 8.2813 123.2176 61.3705 33.3671 174.8749 38 R 4.8291 9.0732 126.0059 54.0955 35.0827 174.4123 39 L 4.5938 8.3928 121.3690 55.8314 42.2955 178.5282 40 N 4.4739 10.0391 120.8066 53.8431 38.0462 174.1834 41 S 4.5495 7.6715 110.1228 57.2245 66.0238 172.3873 42 C 4.8955 8.1433 118.7546 54.7413 40.0695 173.3035 43 H 4.4150 8.2060 115.6039 55.6649 28.3213 176.5723 44 S 4.1335 8.5401 114.4674 60.4412 62.9802 174.6735 45 A 4.4802 7.7718 122.3114 51.8947 19.2026 177.1676 46 C 4.5849 7.7705 118.0367 56.4603 44.0124 173.7025 47 K 3.9972 9.6381 127.3083 57.8417 32.4519 176.8309 48 S 4.4179 8.2303 113.2478 56.3733 64.3209 171.4424 49 C 4.7424 8.4929 126.4316 55.6732 42.3790 172.0550 50 A 4.3818 8.2905 129.9772 51.0050 19.5985 175.2617 51 C 5.4637 8.2988 119.7781 54.9580 43.7787 174.0638 52 T 4.1046 8.6548 112.7481 61.0291 69.7140 174.3434 53 F 4.7212 8.3786 118.8651 57.1323 38.8745 174.6421 54 S 4.7854 7.6784 114.0579 56.4692 65.9618 173.4923 55 I 4.3737 7.9489 120.2975 58.8814 38.5572 174.2990 56 P 4.5085 0.0000 0.0000 61.6609 32.4223 175.7995 57 A 4.3912 8.7004 121.5337 51.9962 19.9404 176.4927 58 Q 5.0083 8.9977 120.6073 54.5730 31.0704 174.3381 59 C 5.7050 9.5109 121.1540 55.2357 45.2952 173.0474 60 F 5.4129 8.8951 116.0247 55.4750 41.6127 172.3310 61 C 4.7304 8.9212 120.6494 56.0160 43.9076 173.5525 62 G 3.6918 9.0399 113.3629 46.9854 0.0000 173.9220 63 D 4.5733 8.0994 120.7508 54.5258 41.4427 175.5662 64 I 4.6281 8.1716 123.4859 59.6717 39.3945 174.7345 65 N 4.9620 8.6923 121.7376 51.5994 42.4370 173.6908 66 D 5.5196 8.6346 116.1500 52.3847 39.8673 175.9028 67 F 4.7982 6.9490 112.4174 57.0909 40.4203 173.3818 68 C 4.8495 8.4178 118.4227 55.1892 42.0782 173.7967 69 Y 4.6073 8.3530 120.8182 57.4630 38.5794 175.9565 70 K 4.2384 8.8016 120.6853 56.4571 33.8875 174.5982 71 P 5.4124 0.0000 0.0000 62.4492 32.3006 177.2055 72 C 4.4586 9.1166 118.8864 57.4441 41.1817 173.8317 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 17 P 0.00 4.52 0.00 1.29 1.95 0.00 3.71 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 1.94 1.91 0.00 18 C 8.42 5.03 0.00 3.37 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 19 C 10.15 5.15 0.00 2.99 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 20 D 9.73 4.25 0.00 2.83 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 21 R 8.67 4.53 0.00 1.82 2.01 0.00 3.06 0.00 0.00 3.08 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 22 C 8.72 5.48 0.00 2.99 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 23 E 9.13 5.00 0.00 1.96 1.76 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 2.20 2.29 0.00 24 C 8.58 5.60 0.00 2.78 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 25 T 8.91 4.15 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 26 K 8.37 4.52 0.00 1.75 1.85 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.40 7.81 27 S 7.80 4.68 0.00 3.98 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 28 I 7.87 4.59 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.95 0.91 0.00 0.00 29 P 0.00 4.48 0.00 2.18 2.06 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 1.98 1.96 0.00 30 P 0.00 4.60 0.00 2.12 2.22 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.85 0.00 31 Q 8.90 4.81 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 32 C 9.37 5.52 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.91 5.10 0.00 1.82 1.71 0.00 3.23 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 34 C 8.91 5.18 0.00 3.19 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 9.13 4.65 0.00 3.77 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 36 D 8.19 4.38 0.00 2.75 2.70 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 37 V 8.28 4.72 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 0.92 0.00 0.00 38 R 9.07 4.83 0.00 1.97 1.74 0.00 3.32 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 39 L 8.39 4.59 0.00 1.60 1.59 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 40 N 10.04 4.47 0.00 2.81 2.97 0.00 0.00 6.85 7.56 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 41 S 7.67 4.55 0.00 3.91 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.14 4.90 0.00 2.81 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 H 8.21 4.42 0.00 3.17 3.45 0.00 5.65 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.54 4.13 0.00 3.98 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 45 A 7.77 4.48 1.26 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 0.00 0.00 46 C 7.77 4.58 0.00 2.54 2.86 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 47 K 9.64 4.00 0.00 1.88 1.85 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.55 7.81 48 S 8.23 4.42 0.00 3.77 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 49 C 8.49 4.74 0.00 2.88 2.94 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 50 A 8.29 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 8.30 5.46 0.00 2.52 2.77 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 52 T 8.65 4.10 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 1.29 0.00 0.00 53 F 8.38 4.72 0.00 3.02 3.08 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 0.00 0.00 0.00 0.00 54 S 7.68 4.79 0.00 3.97 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.95 4.37 1.89 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 1.44 0.97 0.92 0.00 0.00 56 P 0.00 4.51 0.00 2.03 1.99 0.00 3.67 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 2.02 2.07 0.00 57 A 8.70 4.39 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 9.00 5.01 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 59 C 9.51 5.71 0.00 2.92 2.83 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 60 F 8.90 5.41 0.00 3.17 3.07 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 0.00 0.00 0.00 0.00 61 C 8.92 4.73 0.00 2.88 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 62 G 9.04 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 0.00 0.00 0.00 63 D 8.10 4.57 0.00 2.75 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 64 I 8.17 4.63 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.75 0.88 0.00 0.00 65 N 8.69 4.96 0.00 1.83 1.42 0.00 0.00 6.34 8.90 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 66 D 8.63 5.52 0.00 2.81 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 67 F 6.95 4.80 0.00 3.02 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 68 C 8.42 4.85 0.00 3.00 3.08 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 0.00 0.00 0.00 0.00 69 Y 8.35 4.61 0.00 2.88 3.07 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 0.00 0.00 0.00 0.00 70 K 8.80 4.24 0.00 1.87 1.99 0.00 1.54 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.72 1.53 7.81 71 P 0.00 5.41 0.00 1.98 2.06 0.00 3.75 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 72 C 9.12 4.46 0.00 3.28 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