NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 D 4.5789 8.3493 120.2049 54.4253 41.6614 173.2909 34 H 4.9462 7.6302 116.7503 52.5443 32.3605 171.5678 35 Y 4.7961 8.5655 120.1490 55.7071 42.1096 175.1750 36 N 4.4246 8.7670 125.5226 52.1184 38.9105 175.1397 37 C 4.2416 7.7027 122.5949 57.3903 35.0802 176.0105 38 V 3.9055 7.2414 120.0055 64.6958 31.4576 178.1590 39 S 4.1984 7.9681 113.3127 61.0837 62.4184 175.0592 40 S 4.2609 7.9340 114.9350 59.3609 62.8636 174.7111 41 G 4.0183 7.7437 107.0999 45.1495 0.0000 174.1103 42 G 4.0298 7.6870 106.6915 45.8030 0.0000 172.1594 43 Q 4.6501 9.9061 120.1889 54.3462 33.2739 173.4371 44 C 5.2822 8.7690 122.7351 55.0368 41.4556 173.3469 45 L 4.5214 8.4437 127.2466 54.0006 43.1604 177.1217 46 Y 4.2621 8.7360 119.8102 58.7376 39.2130 175.1154 47 S 4.5138 7.7582 112.5989 55.4181 65.4868 173.2466 48 A 3.8046 8.4190 122.6765 52.5807 18.2675 178.0448 49 C 3.9466 8.9596 121.7857 56.4272 44.5917 171.9714 50 P 4.7009 0.0000 0.0000 62.2156 31.7814 177.3833 51 I 3.6359 8.3465 113.8666 63.7796 37.4433 177.2544 52 F 4.1120 8.2935 118.9558 59.5438 38.8205 174.0695 53 T 4.8761 7.8465 109.6730 59.5941 72.1905 173.1674 54 K 4.4165 9.8005 123.6983 55.3378 34.5944 174.8235 55 I 4.4692 8.1292 123.6825 59.6455 38.4858 174.8581 56 Q 4.5757 8.5383 128.1404 56.0949 30.2512 175.0804 57 G 4.2176 8.2764 107.8139 44.7080 0.0000 177.2361 58 T 4.7775 8.8939 113.5047 59.9046 72.3220 172.7227 59 C 4.9948 8.1442 118.2509 55.6990 42.7208 173.0596 60 Y 4.2007 8.4853 117.2819 61.6563 37.8918 176.3771 61 R 4.8322 7.7862 116.1103 53.8594 34.2955 176.3204 62 G 3.7012 8.6062 107.4547 48.3533 0.0000 175.4790 63 K 3.8799 8.1225 118.2748 58.2105 32.2872 176.4074 64 A 5.0458 7.4162 118.8127 49.9842 22.0811 175.7923 65 K 4.6283 8.3268 119.1752 55.0052 36.0150 175.0748 66 C 5.0685 8.7672 123.1348 57.1103 39.7961 173.4562 67 C 5.8106 9.6545 118.4204 55.1008 43.5078 174.2692 68 K 4.1419 8.4442 120.7710 57.1914 31.8395 175.1671 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 33 D 8.35 4.58 0.00 2.66 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 34 H 7.63 4.95 0.00 3.49 3.34 0.00 5.52 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.57 4.80 0.00 2.72 2.74 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 36 N 8.77 4.42 0.00 2.89 2.71 0.00 0.00 7.26 7.68 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 37 C 7.70 4.24 0.00 2.75 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.24 3.91 2.25 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 1.15 0.00 0.00 0.99 0.00 0.00 39 S 7.97 4.20 0.00 3.90 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 40 S 7.93 4.26 0.00 3.94 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 41 G 7.74 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 0.00 0.00 0.00 42 G 7.69 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 43 Q 9.91 4.65 0.00 2.10 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 44 C 8.77 5.28 0.00 2.99 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 45 L 8.44 4.52 0.00 1.72 1.65 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.74 4.26 0.00 2.89 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 47 S 7.76 4.51 0.00 4.00 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 48 A 8.42 3.80 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 49 C 8.96 3.95 0.00 2.95 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 50 P 0.00 4.70 0.00 2.59 2.31 0.00 3.81 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 2.19 2.03 0.00 51 I 8.35 3.64 1.70 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 -0.19 0.85 0.00 0.00 52 F 8.29 4.11 0.00 3.12 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.85 4.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 54 K 9.80 4.42 0.00 1.88 1.72 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.38 7.81 55 I 8.13 4.47 1.88 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 1.42 1.00 0.92 0.00 0.00 56 Q 8.54 4.58 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 5.85 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 57 G 8.28 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.89 4.78 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 1.23 0.00 0.00 59 C 8.14 4.99 0.00 3.10 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 60 Y 8.49 4.20 0.00 3.05 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 R 7.79 4.83 0.00 1.88 1.83 0.00 3.19 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 62 G 8.61 3.70 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 0.00 0.00 0.00 63 K 8.12 3.88 0.00 1.74 1.70 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.40 7.81 64 A 7.42 5.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.33 4.63 0.00 1.78 1.65 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.46 7.81 66 C 8.77 5.07 0.00 2.89 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 67 C 9.65 5.81 0.00 2.80 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 68 K 8.44 4.14 0.00 1.86 1.60 0.00 1.81 0.00 0.00 1.96 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.54 7.81