NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8519 8.3501 109.7383 45.0942 0.0000 172.8961 2 A 4.2070 8.2371 120.7462 51.1235 19.2892 175.5540 3 M 4.4288 9.0680 119.6150 54.7413 34.9118 173.0326 4 E 5.1150 8.4685 123.6841 54.0216 32.8027 174.6593 5 A 4.6325 9.0450 130.3540 52.1673 19.1516 177.4589 6 I 4.1706 8.9642 114.6068 60.7248 39.2623 175.1491 7 Y 4.9473 7.7488 118.5567 55.9849 41.9485 174.7562 8 A 4.6926 8.8157 123.4912 52.2049 19.8096 176.3545 9 Y 4.9696 9.2113 122.0754 55.9401 42.3327 173.7946 10 E 4.6703 8.0962 125.6199 54.1979 30.9379 175.9434 11 A 4.1433 8.6769 128.6448 52.9759 18.8745 177.0716 12 Q 4.5463 9.3650 119.9424 55.5478 30.0645 175.2663 13 G 4.1200 7.3718 106.2459 44.6682 0.0000 174.0477 14 D 4.4638 8.5973 118.8571 56.5038 40.9779 177.3581 15 D 4.6664 8.0446 117.2941 53.6057 40.1316 175.3502 16 E 5.4155 7.9534 119.7915 54.9260 31.9396 175.2568 17 I 4.7657 8.6341 115.1175 59.2192 40.2460 175.4940 18 S 4.8771 8.8031 120.8948 58.5192 63.7341 173.5073 19 I 4.9033 8.7628 116.2671 59.3062 41.1284 173.9126 20 D 5.3336 9.3114 123.0441 51.5375 44.7817 173.8515 21 P 4.3755 0.0000 0.0000 64.7095 31.6804 177.1695 22 G 3.9489 8.9012 111.2863 45.0183 0.0000 173.5358 23 D 4.4180 7.9349 120.7089 54.5523 42.0543 175.5595 24 I 4.7078 8.3048 123.6768 59.9460 38.7288 174.8305 25 I 4.5580 8.7113 129.0307 59.6411 40.0193 175.1348 26 T 4.5823 8.7599 124.2768 62.3461 69.6736 174.4189 27 V 4.0437 8.4916 127.3477 63.3240 31.9547 174.9926 28 I 4.3083 8.8847 128.5485 62.5815 38.8888 176.0939 29 R 4.5009 7.9817 124.9177 54.1426 32.4787 174.7064 30 G 4.1062 8.7812 113.7153 45.5112 0.0000 171.5597 31 D 4.9183 8.9432 119.3893 53.9211 41.8752 176.5216 32 D 4.7394 8.8832 124.1267 53.1338 39.7218 177.3012 33 G 4.0313 8.8234 110.7208 45.8938 0.0000 175.4720 34 S 4.2216 8.1261 113.3422 59.6920 63.5336 175.4131 35 G 3.8573 8.9037 109.2651 44.3413 0.0000 172.2827 36 W 4.9453 7.9770 119.3602 54.9293 32.5156 174.6449 37 T 4.6192 8.1588 120.2269 61.7981 71.0918 172.4788 38 Y 5.0718 8.6382 127.1785 56.6020 40.7709 174.8313 39 G 4.2761 8.4634 112.6507 45.7557 0.0000 170.8779 40 E 5.2750 9.0749 119.7456 54.5498 33.5907 174.9245 41 C 4.6409 9.0210 126.0374 58.0359 34.6895 173.4290 42 D 4.5067 10.0715 127.8650 55.4219 38.1518 175.0130 43 G 4.0304 9.1812 108.2930 45.1993 0.0000 174.6378 44 L 4.4945 7.8459 120.6132 53.4965 42.7377 175.9182 45 K 4.9469 8.7840 120.9271 54.2251 35.8599 176.4346 46 G 4.1377 7.5784 107.6523 46.1677 0.0000 170.9394 47 L 5.3120 8.0446 119.5482 54.3288 43.2798 176.3755 48 F 5.4305 8.6140 116.3949 54.8478 42.2804 171.5360 49 P 3.7427 0.0000 0.0000 62.0962 31.7477 177.6275 50 T 3.8180 8.4291 122.4652 66.8115 68.4865 176.3442 51 S 4.4003 7.8647 112.4871 60.0399 63.3176 173.9368 52 Y 4.7025 8.3556 119.1405 58.5195 37.9808 174.4479 53 C 5.3448 7.8996 117.2476 57.3453 31.6241 174.2322 54 K 4.2022 8.6773 119.6806 56.9711 31.5633 177.3874 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 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 2 A 8.24 4.21 1.25 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 0.00 0.00 3 M 9.07 4.43 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 4 E 8.47 5.12 0.00 2.02 1.73 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 2.21 2.23 0.00 5 A 9.05 4.63 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 6 I 8.96 4.17 1.39 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.62 0.79 0.00 0.00 7 Y 7.75 4.95 0.00 2.55 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 8 A 8.82 4.69 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 9.21 4.97 0.00 2.93 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 10 E 8.10 4.67 0.00 1.69 1.70 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 2.19 2.19 0.00 11 A 8.68 4.14 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 12 Q 9.37 4.55 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 13 G 7.37 4.12 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 0.00 0.00 0.00 14 D 8.60 4.46 0.00 2.65 2.75 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 15 D 8.04 4.67 0.00 2.78 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 16 E 7.95 5.42 0.00 2.13 2.20 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 2.08 2.14 0.00 17 I 8.63 4.77 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.92 1.00 0.00 0.00 18 S 8.80 4.88 0.00 3.81 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 19 I 8.76 4.90 1.78 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.93 0.71 0.00 0.00 20 D 9.31 5.33 0.00 2.55 2.56 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 0.00 0.00 0.00 0.00 21 P 0.00 4.38 0.00 1.99 1.91 0.00 3.69 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 2.02 2.08 0.00 22 G 8.90 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 23 D 7.93 4.42 0.00 2.58 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.30 4.71 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.82 0.89 0.00 0.00 25 I 8.71 4.56 1.73 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.62 0.82 0.00 0.00 26 T 8.76 4.58 4.36 0.00 0.00 0.00 0.00 0.00 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 27 V 8.49 4.04 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 0.83 0.00 0.00 1.04 0.00 0.00 28 I 8.88 4.31 2.02 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.69 1.11 0.00 0.00 29 R 7.98 4.50 0.00 1.95 1.93 0.00 3.37 0.00 0.00 3.34 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 30 G 8.78 4.11 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 0.00 0.00 0.00 31 D 8.94 4.92 0.00 2.69 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.88 4.74 0.00 2.79 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 33 G 8.82 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 0.00 0.00 0.00 34 S 8.13 4.22 0.00 4.20 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 35 G 8.90 3.86 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 0.00 0.00 0.00 36 W 7.98 4.95 0.00 3.16 2.99 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 37 T 8.16 4.62 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 1.17 0.00 0.00 38 Y 8.64 5.07 0.00 3.01 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 39 G 8.46 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 0.00 0.00 0.00 0.00 40 E 9.07 5.27 0.00 1.85 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 41 C 9.02 4.64 0.00 2.85 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 D 10.07 4.51 0.00 2.81 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 43 G 9.18 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 0.00 0.00 0.00 44 L 7.85 4.49 0.00 1.89 1.59 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.78 4.95 0.00 1.71 1.65 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.33 1.46 7.81 46 G 7.58 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.04 5.31 0.00 1.62 1.73 0.66 1.46 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 48 F 8.61 5.43 0.00 3.10 3.20 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 49 P 0.00 3.74 0.00 1.03 0.85 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 50 T 8.43 3.82 4.14 0.00 0.00 0.00 0.00 0.00 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 51 S 7.86 4.40 0.00 4.02 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 52 Y 8.36 4.70 0.00 3.22 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 53 C 7.90 5.34 0.00 3.24 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 54 K 8.68 4.20 0.00 1.75 1.73 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.38 7.81