NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2651 8.2493 123.5546 51.5653 19.8795 176.4997 2 I 4.1188 8.2854 116.0085 60.8552 38.6368 173.1290 3 K 4.8689 10.3423 122.7623 54.6466 36.9517 176.3419 4 L 5.3559 8.4512 120.7691 53.1832 44.3080 176.3736 5 V 4.3210 8.5627 121.8587 61.3925 35.5508 174.0454 6 Q 4.7742 7.7427 123.9499 54.7591 32.4567 174.2285 7 S 4.7195 8.7471 117.6523 57.2682 67.5490 175.2925 8 P 4.7327 0.0000 0.0000 65.5865 31.4836 177.4840 9 N 4.5287 8.5795 115.5137 53.5061 37.6565 175.1006 10 G 3.1403 8.5765 106.0534 45.4296 0.0000 172.1176 11 N 3.6927 7.7382 118.0843 53.1005 38.4696 174.4787 12 F 4.0611 8.1670 128.5973 57.8105 38.7299 174.8049 13 A 3.7829 7.6902 131.3784 51.7745 18.5112 177.0695 14 A 3.1096 5.8000 118.0748 51.5485 18.0311 176.5820 15 S 5.1732 7.2910 106.7981 57.8957 66.1985 173.1019 16 F 5.0749 9.0442 122.4533 57.7839 43.5134 172.4644 17 V 5.0515 6.7000 119.5880 61.0027 34.2574 174.3666 18 L 4.3161 9.4284 128.2406 55.1150 45.6113 174.6301 19 D 4.1671 9.7474 124.2538 55.6126 39.4869 173.4268 20 G 4.0557 8.2523 100.1770 46.6180 0.0000 173.1712 21 T 4.5777 7.9401 114.9265 61.1278 72.0476 173.0989 22 K 4.9784 8.1610 125.4767 55.2923 34.0708 175.6225 23 W 5.2976 9.0522 124.0352 55.3232 33.6580 174.0349 24 I 5.0767 9.0245 122.5719 59.5097 41.4536 173.5903 25 F 4.2677 8.9005 128.9801 59.0990 39.5459 173.8387 26 K 4.0316 6.7266 121.4845 56.7760 34.9887 175.9998 27 S 4.6191 7.4279 113.7675 57.1349 67.6952 172.9565 28 K 5.5689 8.8893 121.0607 56.3731 35.8328 174.2311 29 Y 5.1661 9.3160 118.3013 56.3800 41.8589 172.9211 30 Y 4.0873 8.2394 121.2198 56.3101 39.7086 174.4450 31 D 4.9221 8.0205 128.8629 52.3171 38.6760 176.4183 32 S 4.0166 8.1802 120.5412 61.0097 63.3539 177.0886 33 S 4.2593 8.1298 114.9116 60.4446 62.6684 174.8449 34 K 4.1215 7.7131 117.0821 54.4835 33.8489 176.0409 35 G 3.6302 7.4393 106.5569 45.9423 0.0000 172.4376 36 Y 5.0781 6.6772 115.0498 54.7554 42.4064 174.2673 37 W 4.8732 9.2625 119.7025 56.7038 30.7176 175.9224 38 V 4.8958 8.6930 121.6570 61.7297 35.1984 174.1787 39 G 4.7431 8.9030 111.1542 45.9775 0.0000 171.7802 40 I 5.1651 8.6111 120.6884 59.7187 39.7543 174.9800 41 Y 5.0277 9.1123 123.5631 55.9687 43.1680 174.4978 42 E 5.2573 9.2169 121.3401 55.8287 30.1158 177.3575 43 V 4.7256 8.5618 116.2404 62.4653 38.0589 174.5880 44 W 4.1853 7.5925 129.4339 57.1128 31.2606 174.7065 45 D 4.4313 7.6153 123.4060 53.7564 41.0568 177.2589 46 R 2.9495 6.5760 117.6044 55.9083 30.2472 175.2788 47 K 4.0516 7.4240 122.3203 57.0172 32.0617 175.9456 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 A 8.25 4.27 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 2 I 8.29 4.12 1.99 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 1.37 0.79 0.94 0.00 0.00 3 K 10.34 4.87 0.00 1.72 1.71 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.53 7.81 4 L 8.45 5.36 0.00 1.49 1.57 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.56 4.32 1.93 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 -0.39 0.00 0.00 0.86 0.00 0.00 6 Q 7.74 4.77 0.00 1.46 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.65 0.00 0.00 0.00 0.00 0.00 1.98 2.17 0.00 7 S 8.75 4.72 0.00 3.92 3.88 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 8 P 0.00 4.73 0.00 2.38 2.40 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 9 N 8.58 4.53 0.00 2.89 3.10 0.00 0.00 6.18 7.42 0.00 0.00 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 G 8.58 3.14 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 11 N 7.74 3.69 0.00 2.65 2.59 0.00 0.00 6.97 6.26 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 12 F 8.17 4.06 0.00 2.64 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 13 A 7.69 3.78 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 5.80 3.11 1.09 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 15 S 7.29 5.17 0.00 4.02 3.90 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 0.00 0.00 0.00 0.00 16 F 9.04 5.07 0.00 3.03 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 17 V 6.70 5.05 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 0.83 0.00 0.00 0.91 0.00 0.00 18 L 9.43 4.32 0.00 1.57 1.12 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 19 D 9.75 4.17 0.00 2.82 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 20 G 8.25 4.06 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 0.00 0.00 0.00 21 T 7.94 4.58 4.55 0.00 0.00 0.00 0.00 0.00 0.00 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 22 K 8.16 4.98 0.00 1.73 1.61 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.51 7.81 23 W 9.05 5.30 0.00 3.54 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 9.02 5.08 1.97 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.45 0.96 0.00 0.00 25 F 8.90 4.27 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 26 K 6.73 4.03 0.00 1.46 1.61 0.00 1.72 0.00 0.00 1.52 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.29 7.81 27 S 7.43 4.62 0.00 3.72 3.72 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 28 K 8.89 5.57 0.00 2.28 2.11 0.00 1.33 0.00 0.00 1.81 0.00 0.00 2.48 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.68 1.86 7.81 29 Y 9.32 5.17 0.00 3.06 3.15 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 0.00 0.00 0.00 30 Y 8.24 4.09 0.00 1.55 2.45 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 0.00 0.00 0.00 31 D 8.02 4.92 0.00 2.73 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 32 S 8.18 4.02 0.00 3.94 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 33 S 8.13 4.26 0.00 3.93 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 34 K 7.71 4.12 0.00 0.85 0.74 0.00 1.60 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.18 1.35 7.81 35 G 7.44 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.68 5.08 0.00 3.10 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 37 W 9.26 4.87 0.00 3.73 3.35 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 38 V 8.69 4.90 1.07 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 1.03 0.00 0.00 0.76 0.00 0.00 39 G 8.90 4.74 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 0.00 40 I 8.61 5.17 1.87 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 1.32 0.94 0.94 0.00 0.00 41 Y 9.11 5.03 0.00 3.08 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 42 E 9.22 5.26 0.00 2.12 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 0.00 2.16 2.44 0.00 43 V 8.56 4.73 2.39 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 1.04 0.00 0.00 1.03 0.00 0.00 44 W 7.59 4.19 0.00 1.78 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 0.00 0.00 0.00 0.00 45 D 7.62 4.43 0.00 2.51 2.29 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 46 R 6.58 2.95 0.00 1.54 1.77 0.00 3.06 0.00 0.00 2.98 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.20 0.00 47 K 7.42 4.05 0.00 1.72 1.71 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.45 1.36 7.81