NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.3070 8.3033 120.2300 55.9158 31.6693 177.3198 20 I 3.6091 7.7108 119.3933 61.1606 37.4822 173.1770 21 D 4.7076 8.2719 118.6462 50.8662 43.7918 174.9397 22 Y 4.1943 8.6435 115.3236 61.5958 37.6032 178.9517 23 K 4.1093 8.1799 117.0485 59.2630 32.3623 178.4557 24 D 4.5930 8.0860 119.1290 56.7049 40.9715 178.4137 25 I 3.8277 7.8051 112.8481 63.2848 37.5113 177.5064 26 A 4.2852 8.1139 120.8767 53.5942 18.3457 177.9497 27 T 4.4907 7.7967 106.9140 61.2482 69.8491 174.6771 28 L 5.1783 7.3611 120.0563 53.7524 42.5865 177.8486 29 K 4.2203 7.9506 117.7195 57.4570 32.2534 178.4309 30 N 4.2813 7.8323 117.9614 55.8503 37.4181 175.8956 31 Y 4.5347 7.6778 114.9184 58.3621 38.0235 175.0914 32 I 4.5770 7.1543 121.0673 59.8952 36.4327 175.6716 33 T 4.0442 8.2730 120.7354 61.4954 67.8044 174.8507 34 E 3.8909 8.8337 124.0774 59.5394 29.3033 178.1073 35 S 4.1984 7.9750 111.5296 59.2014 62.5219 174.0334 36 G 4.0332 9.2790 107.7588 46.2583 0.0000 173.2993 37 K 4.6247 7.7113 116.6643 54.2521 36.2652 175.4033 38 I 4.6834 8.1479 121.7566 60.1723 37.4609 176.4908 39 V 3.9687 8.5137 128.3948 60.7320 32.4716 174.4679 40 P 4.3628 0.0000 0.0000 62.6697 32.4024 176.8851 41 S 4.2958 8.8085 115.8809 58.9921 62.4228 175.3856 42 R 3.9203 7.7303 119.2511 60.0783 29.9296 178.0258 43 I 3.9360 7.8199 109.8715 62.9960 37.9873 176.4808 44 T 4.3719 8.3012 108.8266 62.2035 70.4342 175.1550 45 G 4.0698 8.3625 109.9920 45.2603 0.0000 173.7285 46 T 4.0162 7.3492 108.9363 60.6398 69.6090 174.5982 47 R 3.8997 8.6847 123.1098 56.9711 31.7065 177.2346 48 A 3.9943 8.6202 127.0824 55.2044 18.4512 179.9842 49 K 3.8610 8.0670 116.4202 59.9536 32.2214 178.5667 50 Y 4.2346 8.0913 119.0113 60.8334 38.6678 177.9270 51 Q 3.6959 7.9655 119.9361 59.3181 29.0567 178.4352 52 R 4.0770 7.8206 117.1811 59.0275 30.2371 178.6190 53 Q 4.0246 8.4663 119.2610 58.5814 28.6875 177.9510 54 L 4.0644 8.2869 122.2613 57.4719 42.0639 178.9755 55 A 3.8993 8.2698 121.3435 55.3017 18.3031 179.7067 56 R 3.8842 8.1271 113.9079 58.6934 29.9646 178.6317 57 A 3.7710 7.8098 121.0046 55.0974 18.2927 179.0703 58 I 3.5434 7.8198 118.5403 64.6081 37.3611 178.2339 59 K 3.5091 7.7789 120.1592 59.4649 31.9807 178.8926 60 R 3.9564 7.6814 115.5108 59.3799 29.2826 178.7033 61 A 4.3183 7.8597 120.9456 54.7041 18.3075 179.5905 62 R 3.9612 8.2866 117.5738 59.8674 29.9452 178.8577 63 Y 4.5723 7.6332 115.7194 60.5966 38.3381 177.6193 64 L 4.4732 8.0907 118.2768 53.7264 41.6788 177.0274 65 S 3.9015 7.8788 111.5815 59.0372 62.6160 173.4488 66 L 4.1333 7.8489 119.9968 56.8311 41.4751 177.1854 67 L 4.5673 7.7746 121.4820 52.3285 41.1803 173.1533 68 P 4.4802 0.0000 0.0000 61.0376 29.9221 175.1361 69 Y 4.0772 8.3159 123.7150 59.0195 38.5396 176.7903 70 T 2.9402 9.3818 115.2206 64.2863 66.4916 174.9303 71 D 3.6422 7.3603 122.5989 54.3436 43.4432 175.5401 72 R 4.1517 7.7449 119.0565 56.2322 30.5273 176.7220 73 H 4.1970 8.1733 120.4667 56.3419 28.4080 173.3279 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 19 E 8.30 4.31 0.00 2.16 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 0.00 2.06 2.36 0.00 20 I 7.71 3.61 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.63 0.87 0.00 0.00 21 D 8.27 4.71 0.00 2.73 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.64 4.19 0.00 3.15 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 23 K 8.18 4.11 0.00 1.78 1.93 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.60 7.81 24 D 8.09 4.59 0.00 2.78 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 25 I 7.81 3.83 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.07 0.84 0.00 0.00 26 A 8.11 4.29 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 27 T 7.80 4.49 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 1.23 0.00 0.00 28 L 7.36 5.18 0.00 1.67 1.75 0.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.95 4.22 0.00 1.79 1.83 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.56 7.81 30 N 7.83 4.28 0.00 2.62 2.90 0.00 0.00 6.23 7.57 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 31 Y 7.68 4.53 0.00 3.15 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.15 4.58 2.00 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 1.23 0.54 0.95 0.00 0.00 33 T 8.27 4.04 4.27 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 1.33 0.00 0.00 34 E 8.83 3.89 0.00 2.10 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 0.00 2.29 2.39 0.00 35 S 7.98 4.20 0.00 3.87 3.93 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 36 G 9.28 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 37 K 7.71 4.62 0.00 1.78 1.65 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 38 I 8.15 4.68 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.96 0.00 0.00 39 V 8.51 3.97 2.14 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 0.83 0.00 0.00 0.96 0.00 0.00 40 P 0.00 4.36 0.00 2.12 2.20 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 41 S 8.81 4.30 0.00 3.70 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 42 R 7.73 3.92 0.00 1.86 2.03 0.00 3.22 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 43 I 7.82 3.94 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.58 0.94 0.00 0.00 44 T 8.30 4.37 4.33 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 1.40 0.00 0.00 45 G 8.36 4.07 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 0.00 0.00 0.00 46 T 7.35 4.02 4.41 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 1.34 0.00 0.00 47 R 8.68 3.90 0.00 1.88 1.88 0.00 3.15 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 48 A 8.62 3.99 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 49 K 8.07 3.86 0.00 1.81 1.92 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.46 7.81 50 Y 8.09 4.23 0.00 2.92 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 51 Q 7.97 3.70 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 52 R 7.82 4.08 0.00 2.04 1.95 0.00 3.36 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 53 Q 8.47 4.02 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 54 L 8.29 4.06 0.00 1.44 1.54 0.81 0.84 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 55 A 8.27 3.90 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.13 3.88 0.00 1.99 2.13 0.00 2.75 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 57 A 7.81 3.77 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 58 I 7.82 3.54 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.64 0.83 0.00 0.00 59 K 7.78 3.51 0.00 1.65 1.84 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.31 0.97 7.81 60 R 7.68 3.96 0.00 2.18 2.14 0.00 2.57 0.00 0.00 2.45 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.10 0.00 61 A 7.86 4.32 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.29 3.96 0.00 1.58 1.63 0.00 2.94 0.00 0.00 2.83 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 63 Y 7.63 4.57 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.09 4.47 0.00 2.11 1.75 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.88 3.90 0.00 4.13 4.07 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 66 L 7.85 4.13 0.00 1.85 1.88 0.60 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.77 4.57 0.00 1.60 1.53 0.96 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.48 0.00 2.24 2.06 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 1.98 1.95 0.00 69 Y 8.32 4.08 0.00 3.12 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 70 T 9.38 2.94 4.33 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 1.35 0.00 0.00 71 D 7.36 3.64 0.00 2.86 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 72 R 7.74 4.15 0.00 1.87 2.01 0.00 3.13 0.00 0.00 3.01 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.47 0.00 73 H 8.17 4.20 0.00 2.72 3.09 0.00 5.78 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00