NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3020 8.2644 123.5829 49.7352 19.2244 176.3917 3 K 3.9851 8.2736 118.8713 57.6972 38.1972 172.5916 4 H 3.2636 7.9174 108.7861 56.3466 30.4271 173.5090 5 P 4.5383 0.0000 0.0000 63.1360 32.9167 176.9403 6 V 4.4625 7.8385 118.7070 59.2593 34.2449 172.6331 7 P 4.2329 0.0000 0.0000 62.8469 31.3650 176.5072 8 K 4.1464 8.7527 125.5055 58.6260 32.5143 177.0627 9 K 4.6253 7.5193 115.1175 53.8130 35.9701 175.7395 10 K 4.0016 8.6213 123.4738 56.3756 32.3720 176.8983 11 T 4.0268 8.3885 117.3615 61.3211 69.5390 174.7992 12 S 4.2780 8.4684 119.5213 58.2295 65.0993 175.3642 13 K 3.8243 8.8324 123.6429 60.6015 31.7681 178.1789 14 A 3.9828 8.2584 119.9992 54.6687 17.8452 178.7689 15 R 3.9119 7.7912 118.9273 58.9943 30.7570 179.0813 16 R 4.0088 8.0455 118.4338 59.6847 29.9422 178.2733 17 D 4.4648 8.1509 117.8761 56.5451 40.6536 178.0793 18 A 4.1826 8.2527 120.7850 53.5441 18.4760 178.4400 19 R 4.4767 7.6207 112.9858 56.8723 31.0989 177.7619 20 R 4.5654 7.5256 117.3617 56.4448 30.1167 177.7907 21 S 4.2723 8.0208 114.2085 60.5733 63.2258 174.1633 22 H 4.6605 8.1341 119.8128 57.6757 29.9422 176.4291 23 H 4.0605 8.3794 114.6745 57.3861 28.7372 174.9953 24 A 3.8866 7.5531 121.7924 52.5064 18.3446 177.0167 25 L 4.2276 8.4403 125.3838 54.8979 43.0151 176.2913 26 T 4.4997 8.1325 115.4988 59.5391 70.5536 172.6538 27 P 4.4502 0.0000 0.0000 61.4161 32.2282 174.2346 28 P 4.3268 0.0000 0.0000 63.2432 31.7310 175.5637 29 T 4.4167 8.2832 108.1442 60.1320 69.0717 173.0298 30 L 4.9586 8.2173 125.8412 53.1216 44.7781 176.4715 31 V 4.6200 8.4773 113.5918 59.1314 36.6194 172.7201 32 P 4.7559 0.0000 0.0000 62.5655 31.7746 176.0903 33 C 4.1436 9.1178 125.7475 58.7074 31.7840 171.1303 34 P 4.3659 0.0000 0.0000 66.7534 32.7191 178.4867 35 E 4.3039 8.5333 121.5907 55.7715 28.4509 179.6394 36 C 3.6374 9.0660 121.2273 57.9638 30.5830 176.1393 37 K 4.3309 8.6318 122.7958 56.9576 31.9592 176.3176 38 A 4.6610 8.4135 121.4096 52.0167 20.9740 177.2624 39 M 4.6564 8.4374 119.8840 54.9829 33.4030 175.9692 40 K 4.6510 9.0415 120.1115 54.5146 37.4377 173.2546 41 P 4.9073 0.0000 0.0000 61.6182 32.0845 174.4080 42 P 4.2734 0.0000 0.0000 63.4742 31.7425 175.4065 43 H 4.4008 8.6520 112.2246 56.8511 26.3031 174.8689 44 T 4.4403 7.3692 109.1184 59.5150 71.3135 175.3007 45 V 3.7246 7.7994 124.4947 62.0206 28.8583 174.3647 46 C 3.7469 7.5799 120.3357 57.8041 29.5183 173.1386 47 P 4.5668 0.0000 0.0000 62.5708 31.0160 176.5954 48 E 4.8010 8.0711 109.4142 57.6066 31.8874 175.7646 49 C 3.8449 8.0350 109.1547 60.9028 26.3141 175.8555 50 G 3.8231 8.2941 109.6714 44.6016 0.0000 172.4033 51 Y 4.4951 6.8788 122.4476 56.0133 39.4999 170.5968 52 Y 4.8221 6.5581 119.6984 56.3296 41.9295 175.9118 53 A 3.9818 8.6089 123.1794 50.9465 15.5503 181.5921 54 G 3.7881 9.4276 109.0171 49.8514 0.0000 172.2627 55 R 3.5444 7.4437 123.4521 54.2899 31.2000 175.9142 56 K 4.3744 8.2327 125.8033 60.7444 33.5583 177.4234 57 V 3.1615 7.5332 115.1475 63.2194 30.3385 173.3779 58 L 4.2151 7.6732 123.2402 57.5125 40.7835 176.2063 59 E 4.5941 8.4472 115.4228 56.2701 29.8837 176.9091 60 V 3.9069 7.7471 124.1922 61.8872 31.8040 175.5806 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 2 A 8.26 4.30 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 3 K 8.27 3.99 0.00 1.88 1.82 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.18 1.56 7.81 4 H 7.92 3.26 0.00 3.21 3.03 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.54 0.00 2.18 2.04 0.00 3.79 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 1.99 1.95 0.00 6 V 7.84 4.46 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 0.74 0.00 0.00 0.94 0.00 0.00 7 P 0.00 4.23 0.00 2.06 2.07 0.00 3.68 0.00 0.00 3.59 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 8 K 8.75 4.15 0.00 1.69 1.83 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.52 7.81 9 K 7.52 4.63 0.00 1.72 1.63 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.34 7.81 10 K 8.62 4.00 0.00 1.71 1.74 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 T 8.39 4.03 4.24 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 1.21 0.00 0.00 12 S 8.47 4.28 0.00 4.07 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 13 K 8.83 3.82 0.00 1.81 1.92 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.53 7.81 14 A 8.26 3.98 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 15 R 7.79 3.91 0.00 1.86 2.01 0.00 3.27 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 16 R 8.05 4.01 0.00 1.92 2.09 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 17 D 8.15 4.46 0.00 2.75 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 18 A 8.25 4.18 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.62 4.48 0.00 2.03 2.27 0.00 3.10 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 20 R 7.53 4.57 0.00 1.87 1.93 0.00 3.09 0.00 0.00 3.10 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.91 0.00 21 S 8.02 4.27 0.00 3.93 3.97 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 22 H 8.13 4.66 0.00 3.19 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 23 H 8.38 4.06 0.00 3.11 3.42 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.55 3.89 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 25 L 8.44 4.23 0.00 1.63 1.58 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.13 4.50 4.24 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 1.21 0.00 0.00 27 P 0.00 4.45 0.00 2.20 2.09 0.00 3.78 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 1.95 0.00 28 P 0.00 4.33 0.00 2.20 2.13 0.00 3.73 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 1.99 1.96 0.00 29 T 8.28 4.42 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 1.21 0.00 0.00 30 L 8.22 4.96 0.00 1.52 1.60 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.48 4.62 2.11 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 0.73 0.00 0.00 1.08 0.00 0.00 32 P 0.00 4.76 0.00 1.95 2.00 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 33 C 9.12 4.14 0.00 3.14 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 34 P 0.00 4.37 0.00 2.35 2.25 0.00 3.86 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 35 E 8.53 4.30 0.00 2.01 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 2.38 2.28 0.00 36 C 9.07 3.64 0.00 3.11 3.06 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 37 K 8.63 4.33 0.00 1.87 1.95 0.00 1.45 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.50 7.81 38 A 8.41 4.66 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 39 M 8.44 4.66 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 40 K 9.04 4.65 0.00 1.61 1.63 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.33 1.35 7.81 41 P 0.00 4.91 0.00 2.07 2.05 0.00 3.39 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 42 P 0.00 4.27 0.00 2.31 2.22 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 43 H 8.65 4.40 0.00 3.21 3.47 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.37 4.44 4.13 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 0.00 0.00 1.22 0.00 0.00 45 V 7.80 3.72 1.85 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 1.10 0.00 0.00 0.45 0.00 0.00 46 C 7.58 3.75 0.00 2.96 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 47 P 0.00 4.57 0.00 2.15 2.11 0.00 3.77 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 48 E 8.07 4.80 0.00 1.90 1.88 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 2.11 2.21 0.00 49 C 8.03 3.84 0.00 3.12 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 50 G 8.29 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 0.00 0.00 0.00 51 Y 6.88 4.50 0.00 2.76 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 52 Y 6.56 4.82 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.61 3.98 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 54 G 9.43 3.79 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 0.00 0.00 0.00 55 R 7.44 3.54 0.00 1.80 1.81 0.00 3.31 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 1.61 1.81 0.00 56 K 8.23 4.37 0.00 1.88 1.98 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.29 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.42 7.81 57 V 7.53 3.16 2.05 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 0.69 0.00 0.00 0.91 0.00 0.00 58 L 7.67 4.22 0.00 1.75 1.75 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.45 4.59 0.00 1.96 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 2.22 2.21 0.00 60 V 7.75 3.91 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 0.69 0.00 0.00 0.93 0.00 0.00