NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2797 8.1749 117.3707 63.4395 69.9062 172.9829 3 S 4.6289 8.1452 121.0620 56.3563 66.4693 171.7253 4 Y 4.7601 8.3762 120.5522 56.3494 42.1005 174.8373 5 T 4.7363 8.5240 113.3268 59.6966 71.7219 172.9820 6 L 4.8190 8.4527 125.4934 53.2624 45.2593 174.9873 7 N 5.1549 8.5696 121.6848 51.6518 41.9795 173.6910 8 E 4.6362 8.3201 119.8680 54.9724 33.6350 175.1311 9 V 3.6674 8.3844 123.2141 62.7244 31.5493 175.7992 10 V 4.3736 8.1453 127.5087 60.2510 32.6066 173.6412 11 P 4.6449 0.0000 0.0000 61.5341 29.3290 176.6371 12 L 4.1095 8.4434 127.4939 59.0998 41.5998 178.6624 13 K 3.8637 8.0329 116.5007 59.6393 32.0263 178.5180 14 E 3.9064 7.7668 117.1334 57.8142 29.4100 177.4379 15 F 4.9485 7.6655 115.6841 56.9546 41.2894 175.6751 16 V 4.5120 7.4682 118.5280 59.8397 34.0144 173.1074 17 P 4.5365 0.0000 0.0000 62.4229 31.8863 176.5190 18 E 4.0248 8.8033 119.0618 58.3471 29.5736 177.8118 19 W 4.7516 8.0903 117.6173 54.8170 31.2846 175.2932 20 V 4.6633 8.3347 114.8601 59.6771 35.1759 174.7735 21 R 4.6755 8.4307 119.9732 54.3930 32.2671 175.8565 22 I 4.4167 7.5793 114.5026 59.2434 40.0345 175.7212 23 G 3.7994 7.2937 107.7314 45.8884 0.0000 172.3129 24 F 4.9879 8.4594 116.8634 55.6810 42.1917 174.5430 25 S 4.6891 8.3606 115.5925 56.8214 65.4913 173.0872 26 A 4.5567 8.1146 126.8549 51.1838 21.7430 175.4581 27 T 4.7876 8.0468 110.4993 60.1181 72.2374 172.7740 28 T 4.9675 8.2470 110.4715 60.0406 73.3588 175.5130 29 G 4.1929 8.4542 110.5283 45.9072 0.0000 175.5051 30 A 4.1475 9.3173 128.3172 53.5080 19.1335 177.9274 31 E 4.6508 7.9168 115.7061 54.5096 32.3671 174.0255 32 F 5.2135 7.2982 115.3111 56.0864 40.7455 172.8625 33 A 4.4825 8.1962 121.5876 51.4032 21.5287 175.5796 34 A 4.5305 8.3019 122.6171 51.2322 20.2212 176.8770 35 H 4.8608 8.6256 118.0586 54.0092 31.3161 173.2374 36 E 4.7158 8.5517 122.7354 54.3072 33.2902 175.1075 37 V 4.2393 7.9880 119.6409 61.1595 34.0304 175.3572 38 L 4.5069 8.2926 125.5245 55.6676 42.9256 176.3901 39 S 4.7540 7.5452 110.0346 57.3502 65.2608 173.7761 40 W 5.5897 8.6713 130.3976 56.2360 33.4987 173.3200 41 Y 4.7987 9.1206 125.7500 55.6759 40.9994 174.2040 42 F 4.5239 7.3291 127.1224 56.6710 42.6551 172.9874 43 H 4.3802 6.9579 125.4195 54.3923 32.6793 172.4722 44 S 4.4079 7.7438 119.6927 56.3001 65.9744 173.1776 45 E 4.2726 8.3182 121.3695 54.6469 31.4573 174.1081 46 L 4.4385 8.3018 128.3970 52.8996 43.4728 175.8274 47 A 4.1448 8.5102 127.8610 52.5200 18.3202 176.7505 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 4.28 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 1.09 0.00 0.00 3 S 8.15 4.63 0.00 3.79 3.69 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 4 Y 8.38 4.76 0.00 2.88 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 8.52 4.74 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 8.45 4.82 0.00 1.58 1.55 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.57 5.15 0.00 2.69 2.67 0.00 0.00 6.83 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 8.32 4.64 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 9 V 8.38 3.67 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 0.79 0.00 0.00 0.95 0.00 0.00 10 V 8.15 4.37 2.15 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 1.00 0.00 0.00 0.95 0.00 0.00 11 P 0.00 4.64 0.00 2.18 2.21 0.00 4.01 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 12 L 8.44 4.11 0.00 1.79 1.83 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.03 3.86 0.00 1.62 1.81 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.50 7.81 14 E 7.77 3.91 0.00 1.16 1.44 0.00 0.00 0.00 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 2.17 0.00 15 F 7.67 4.95 0.00 3.07 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 16 V 7.47 4.51 2.31 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 0.88 0.00 0.00 1.00 0.00 0.00 17 P 0.00 4.54 0.00 2.36 2.04 0.00 3.78 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 8.80 4.02 0.00 2.02 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 2.26 2.32 0.00 19 W 8.09 4.75 0.00 3.19 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 20 V 8.33 4.66 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 0.82 0.00 0.00 0.95 0.00 0.00 21 R 8.43 4.68 0.00 1.78 1.81 0.00 3.17 0.00 0.00 3.27 7.35 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 7.58 4.42 1.67 0.00 0.00 -0.49 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 0.45 0.69 0.00 0.00 23 G 7.29 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.99 0.00 2.80 2.66 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 0.00 0.00 0.00 0.00 25 S 8.36 4.69 0.00 3.76 3.66 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 0.00 0.00 0.00 0.00 26 A 8.11 4.56 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 4.79 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 8.25 4.97 4.53 0.00 0.00 0.00 0.00 0.00 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 29 G 8.45 4.19 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 0.00 0.00 0.00 30 A 9.32 4.15 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 7.92 4.65 0.00 1.99 1.74 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 2.16 2.10 0.00 32 F 7.30 5.21 0.00 3.09 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 33 A 8.20 4.48 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 34 A 8.30 4.53 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 8.63 4.86 0.00 3.04 3.12 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.55 4.72 0.00 1.84 1.74 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 2.16 2.22 0.00 37 V 7.99 4.24 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.06 0.00 0.00 38 L 8.29 4.51 0.00 1.64 1.70 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.55 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 8.67 5.59 0.00 3.32 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 9.12 4.80 0.00 3.02 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 42 F 7.33 4.52 0.00 2.37 2.31 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 43 H 6.96 4.38 0.00 2.79 2.89 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.74 4.41 0.00 3.86 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.32 4.27 0.00 1.81 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 46 L 8.30 4.44 0.00 1.48 1.43 0.83 0.89 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 47 A 8.51 4.14 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00