NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.6853 8.4249 119.2055 52.4025 39.4713 174.0333 7 P 4.1960 0.0000 0.0000 62.2028 31.7947 174.5981 8 L 4.7475 9.0836 122.6993 53.9398 45.4865 175.3871 9 H 4.8652 8.9683 113.8306 56.8653 26.7428 177.3321 10 A 4.0323 7.6635 124.3137 55.6450 18.2715 180.5056 11 Y 3.8931 7.9751 111.4798 60.1823 37.9907 176.7226 12 F 4.6367 7.8147 117.0774 57.8483 39.5385 175.5379 13 K 4.6388 7.4907 120.7829 54.4920 34.3131 175.8023 14 L 4.2137 8.1713 119.0629 54.2396 42.1433 175.5155 15 P 4.2909 0.0000 0.0000 63.1744 31.7203 175.9096 16 N 4.9921 8.6025 117.3139 52.4561 37.9341 173.9294 17 T 4.7257 7.5637 107.1912 60.1794 72.0124 173.1499 18 V 4.4742 8.0926 120.8571 61.2311 34.6217 174.8929 19 S 4.6506 8.4664 121.3135 56.6902 66.1681 173.2881 20 L 4.5412 8.4709 124.9655 53.5853 42.6770 176.3331 21 V 4.5378 7.8709 114.9404 60.0006 35.8932 174.3510 22 A 4.4642 7.9537 121.1128 51.8811 21.5251 175.7360 23 G 4.1235 8.1854 108.4207 45.4614 0.0000 172.2899 24 S 4.5829 8.2924 113.2889 57.1757 66.1143 173.1193 25 S 4.4595 7.9052 112.8133 58.1315 64.5436 175.3165 26 E 4.4898 8.5936 124.2538 55.5639 30.8162 175.7168 27 G 4.1705 7.7786 106.0749 44.9805 0.0000 173.8543 28 E 4.1476 8.8435 120.8593 58.4711 30.0019 177.7174 29 T 4.7687 7.4412 107.6954 58.2429 73.3048 172.7305 30 P 4.2448 0.0000 0.0000 65.9166 31.2986 178.7362 31 L 4.0293 7.8881 118.4379 58.2859 41.9775 178.6182 32 N 4.3764 8.3530 116.3575 56.0520 38.4231 177.3438 33 A 4.1606 8.4564 122.7556 55.0066 18.4343 179.3258 34 F 4.1220 8.6269 119.6103 61.5467 39.3985 176.6694 35 D 4.3341 8.5616 117.8951 57.4908 40.9382 178.5114 36 G 3.6753 8.6522 107.4202 47.0790 0.0000 175.5293 37 A 3.9300 7.9796 122.9924 54.8955 18.3959 179.6768 38 L 3.7249 7.7057 117.5939 57.8993 41.7987 179.7511 39 L 3.9307 8.0852 119.1784 57.8901 41.3313 179.1855 40 N 4.3051 8.2021 116.0457 56.4381 38.9707 176.3704 41 A 4.5409 7.3704 122.3676 52.5725 18.6040 178.2943 42 G 3.9472 8.0336 104.9458 45.2908 0.0000 173.4628 43 I 4.5560 7.5516 118.7336 60.4221 38.4369 176.7220 44 G 3.7553 8.3203 108.6028 46.7957 0.0000 174.7334 45 N 5.0055 7.9984 116.9091 53.0613 39.2995 174.4290 46 V 4.4728 7.5411 109.3699 59.4780 35.5082 175.1399 47 N 4.6966 8.5160 118.9147 52.0650 38.5757 175.1843 48 L 4.2140 8.4570 124.3116 54.0721 42.4807 176.6478 49 I 4.2715 8.1022 124.7255 59.1287 37.7402 175.3755 50 R 4.0267 8.5693 126.9833 56.0377 30.4425 175.6822 51 I 4.5467 8.2062 118.8414 59.1849 39.8257 175.6433 52 S 4.2224 8.3150 115.7713 58.6811 63.0366 173.6955 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 6 N 8.42 4.69 0.00 2.70 2.84 0.00 0.00 7.04 6.80 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 7 P 0.00 4.20 0.00 2.16 1.98 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 8 L 9.08 4.75 0.00 1.66 1.47 0.90 1.16 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 9 H 8.97 4.87 0.00 3.48 3.62 0.00 5.65 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.66 4.03 1.19 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 11 Y 7.98 3.89 0.00 2.62 2.78 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 0.00 0.00 0.00 12 F 7.81 4.64 0.00 3.31 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.49 4.64 0.00 1.89 1.79 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.63 7.81 14 L 8.17 4.21 0.00 1.61 1.59 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.29 0.00 2.01 1.96 0.00 3.60 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 2.02 2.06 0.00 16 N 8.60 4.99 0.00 2.72 2.80 0.00 0.00 5.85 7.71 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 17 T 7.56 4.73 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 1.18 0.00 0.00 18 V 8.09 4.47 2.07 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 0.86 0.00 0.00 0.92 0.00 0.00 19 S 8.47 4.65 0.00 3.83 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 20 L 8.47 4.54 0.00 1.62 1.59 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.87 4.54 2.21 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 0.71 0.00 0.00 0.91 0.00 0.00 22 A 7.95 4.46 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.19 4.12 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 0.00 24 S 8.29 4.58 0.00 3.96 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 25 S 7.91 4.46 0.00 3.79 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 26 E 8.59 4.49 0.00 2.00 1.88 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 2.27 2.24 0.00 27 G 7.78 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.84 4.15 0.00 1.98 2.03 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 2.32 2.30 0.00 29 T 7.44 4.77 4.25 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 0.00 0.00 0.00 1.22 0.00 0.00 30 P 0.00 4.24 0.00 2.17 2.15 0.00 3.60 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 2.11 2.16 0.00 31 L 7.89 4.03 0.00 1.75 1.69 0.97 0.68 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 32 N 8.35 4.38 0.00 3.03 2.87 0.00 0.00 6.90 7.70 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 33 A 8.46 4.16 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.63 4.12 0.00 3.16 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 35 D 8.56 4.33 0.00 3.02 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 36 G 8.65 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 0.00 0.00 0.00 37 A 7.98 3.93 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.71 3.72 0.00 1.64 1.57 -0.06 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.09 3.93 0.00 1.81 1.69 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 N 8.20 4.31 0.00 2.75 2.97 0.00 0.00 7.25 7.74 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 41 A 7.37 4.54 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 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 0.00 0.00 0.00 43 I 7.55 4.56 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.98 0.90 0.00 0.00 44 G 8.32 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 45 N 8.00 5.01 0.00 2.68 2.80 0.00 0.00 6.71 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 46 V 7.54 4.47 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 0.75 0.00 0.00 0.98 0.00 0.00 47 N 8.52 4.70 0.00 2.72 2.79 0.00 0.00 6.96 7.85 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 48 L 8.46 4.21 0.00 1.71 1.66 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.10 4.27 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.86 0.93 0.00 0.00 50 R 8.57 4.03 0.00 1.80 1.86 0.00 3.23 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 51 I 8.21 4.55 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 1.48 0.81 0.92 0.00 0.00 52 S 8.32 4.22 0.00 3.94 3.81 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