NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2618 8.1749 117.3671 63.5184 69.8552 172.9350 3 S 4.5890 7.9747 120.7915 56.5554 67.0106 171.6186 4 Y 4.7540 9.1962 120.1185 56.6971 42.3491 174.9047 5 T 4.7789 8.5088 119.6712 61.6707 72.3078 173.0596 6 L 4.9147 8.3237 125.3152 53.4349 45.4567 175.2230 7 N 5.1204 8.3822 119.7444 51.9011 42.6071 173.4536 8 E 4.6287 8.3338 120.0061 55.1185 32.5735 174.3739 9 V 4.0333 8.2703 124.2249 61.6143 32.1722 175.9488 10 V 4.4342 8.1556 126.5279 58.9982 32.5102 173.8467 11 P 4.6106 0.0000 0.0000 62.5619 28.8453 176.7389 12 L 4.1310 8.2936 127.5363 58.6351 41.5960 178.3562 13 K 3.8649 8.0582 118.1855 59.2002 32.1021 177.6237 14 E 4.0424 7.7941 116.7130 56.9209 29.6076 176.8069 15 F 4.8893 7.5955 115.9876 57.9995 41.4130 175.8283 16 V 4.4897 7.5605 111.6000 58.4948 33.7661 173.7052 17 P 4.5422 0.0000 0.0000 62.3298 31.9155 176.6371 18 E 4.0087 8.8738 119.0311 58.5781 29.4871 177.9496 19 W 4.6754 8.0629 116.7937 54.8248 31.4439 175.2228 20 V 4.6745 8.2472 114.3226 59.8214 35.3181 174.7040 21 R 4.7311 8.4130 119.5313 54.3457 32.6878 175.6456 22 I 4.5011 7.6786 113.5362 59.0138 40.3995 175.8254 23 G 3.7615 7.1794 107.1196 46.0281 0.0000 172.2092 24 F 4.9080 8.4831 116.9642 55.6183 42.5513 174.2611 25 S 4.7525 8.3765 116.1576 56.9582 66.0944 172.8487 26 A 4.5572 8.0324 122.1897 51.5384 21.6420 175.5099 27 T 4.7461 7.9206 109.0003 60.3569 71.9666 172.8005 28 T 4.9672 8.2856 111.1266 60.0342 73.2638 175.6595 29 G 4.2332 8.3307 111.5451 45.7778 0.0000 175.7784 30 A 4.1730 9.1967 128.5703 53.4704 18.8321 177.7908 31 E 4.5043 7.8216 114.7535 54.8735 32.2102 174.1414 32 F 4.9815 6.9900 113.2990 56.6467 40.3588 172.5818 33 A 4.4460 8.1427 121.5824 51.5581 21.4225 175.5095 34 A 4.5103 8.3496 122.5582 51.4212 20.0278 176.8828 35 H 4.9154 8.5735 117.9424 53.9758 31.7292 173.2376 36 E 4.6511 8.4990 122.3016 54.5245 33.4879 174.6559 37 V 4.2095 8.0737 120.9465 61.1197 33.6155 175.3730 38 L 4.4372 8.3906 126.2026 56.1806 42.6422 176.4790 39 S 4.7538 7.6218 109.9512 57.3629 65.4368 173.5185 40 W 5.4467 8.5821 130.2277 56.5485 33.3747 173.0154 41 Y 4.8544 9.0581 126.2598 55.6369 40.8579 174.1759 42 F 4.4605 7.5683 127.2416 56.3683 42.6453 173.2755 43 H 4.4557 6.8607 124.7546 54.2344 32.6706 172.5865 44 S 4.5201 7.9817 120.1433 56.1255 65.8861 173.0222 45 E 4.5717 8.3535 119.0157 54.4110 32.1947 174.6740 46 L 4.5098 8.2487 122.7055 53.0004 44.7418 175.7045 47 A 4.2207 8.6245 129.1613 52.1381 19.2903 177.1984 48 G 3.7593 8.3024 108.6224 46.4402 0.0000 173.5303 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 T 8.17 4.26 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 1.09 0.00 0.00 3 S 7.97 4.59 0.00 3.78 3.68 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 0.00 0.00 0.00 4 Y 9.20 4.75 0.00 2.88 2.82 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 5 T 8.51 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 1.24 0.00 0.00 6 L 8.32 4.91 0.00 1.55 1.50 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.38 5.12 0.00 2.70 2.65 0.00 0.00 6.69 7.66 0.00 0.00 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 E 8.33 4.63 0.00 1.87 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 9 V 8.27 4.03 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 0.92 0.00 0.00 0.95 0.00 0.00 10 V 8.16 4.43 2.12 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 0.90 0.00 0.00 1.03 0.00 0.00 11 P 0.00 4.61 0.00 2.09 2.25 0.00 3.94 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 12 L 8.29 4.13 0.00 1.74 1.82 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.06 3.86 0.00 1.69 1.77 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.49 7.81 14 E 7.79 4.04 0.00 1.16 1.41 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 2.11 2.12 0.00 15 F 7.60 4.89 0.00 3.01 2.97 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 16 V 7.56 4.49 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 0.77 0.00 0.00 1.05 0.00 0.00 17 P 0.00 4.54 0.00 2.34 2.06 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 18 E 8.87 4.01 0.00 2.06 1.91 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 2.28 2.35 0.00 19 W 8.06 4.68 0.00 3.23 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 20 V 8.25 4.67 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 0.78 0.00 0.00 0.94 0.00 0.00 21 R 8.41 4.73 0.00 1.77 1.80 0.00 3.15 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 22 I 7.68 4.50 1.73 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.49 0.78 0.00 0.00 23 G 7.18 3.76 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 0.00 0.00 0.00 24 F 8.48 4.91 0.00 2.77 2.68 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 0.00 0.00 0.00 25 S 8.38 4.75 0.00 3.90 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.03 4.56 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 27 T 7.92 4.75 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 1.20 0.00 0.00 28 T 8.29 4.97 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 1.33 0.00 0.00 29 G 8.33 4.23 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 0.00 30 A 9.20 4.17 1.31 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 0.00 0.00 31 E 7.82 4.50 0.00 1.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 32 F 6.99 4.98 0.00 3.06 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 33 A 8.14 4.45 1.12 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 34 A 8.35 4.51 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 35 H 8.57 4.92 0.00 3.02 3.11 0.00 5.85 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 36 E 8.50 4.65 0.00 1.84 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 2.17 2.25 0.00 37 V 8.07 4.21 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 0.49 0.00 0.00 0.03 0.00 0.00 38 L 8.39 4.44 0.00 1.65 1.71 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.62 4.75 0.00 4.05 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 40 W 8.58 5.45 0.00 3.32 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 41 Y 9.06 4.85 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.57 4.46 0.00 2.40 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 H 6.86 4.46 0.00 2.85 2.85 0.00 5.92 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.98 4.52 0.00 3.90 3.73 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 45 E 8.35 4.57 0.00 2.00 1.87 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 2.11 2.23 0.00 46 L 8.25 4.51 0.00 1.43 1.44 0.83 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.62 4.22 1.22 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 48 G 8.30 3.76 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 0.00 0.00 0.00