NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -7 M 4.2515 8.3049 120.3409 54.1958 34.6198 175.1955 -6 H 3.8559 8.4552 114.6342 55.1802 26.2013 173.4386 -5 H 3.9813 8.2680 118.2349 57.1669 31.2494 173.1956 -4 H 4.5791 8.2464 125.4597 54.9472 32.4448 171.8563 -3 H 4.4351 8.5124 124.5243 54.6371 28.9326 174.2658 -2 H 4.7192 8.3736 124.7895 55.6204 30.8196 174.1436 -1 H 4.6822 8.8419 122.0770 53.7068 32.1694 174.2715 0 A 3.9559 8.8762 127.5616 55.4908 18.2048 177.8613 1 M 4.4020 7.8863 112.3151 55.3312 32.2416 176.1958 2 E 4.1984 8.3315 119.3584 56.6144 31.0351 175.9736 3 E 5.0545 8.8048 121.0104 54.9785 32.4482 175.2495 4 V 4.7661 9.3294 117.3914 59.8020 36.6482 174.6117 5 T 5.0791 8.6603 117.3561 62.0317 71.2441 173.7960 6 I 4.5289 8.9581 127.6715 59.5296 39.7414 174.9362 7 K 4.5531 9.2397 128.0375 55.4724 33.3481 176.0616 8 A 4.9168 9.1725 129.4377 50.4864 20.6211 175.8981 9 N 4.9049 9.0703 121.6837 53.0280 39.4443 174.5988 10 L 4.7280 9.2115 125.6812 54.0893 43.3963 176.2417 11 I 4.6319 8.8107 125.0392 59.5892 39.9746 175.0896 12 F 5.0931 8.8829 125.9950 55.9452 40.5623 177.0141 13 A 4.0897 8.2738 122.3405 55.7158 18.2047 178.6424 14 N 4.6210 8.2950 109.8556 52.8944 37.2545 175.8771 15 A 3.8504 8.4846 120.4395 52.7378 17.6186 179.0677 16 S 4.5223 8.6505 111.8802 58.4304 63.8355 173.1219 17 T 5.3830 7.9824 110.2258 60.7093 72.3515 172.8541 18 Q 4.6028 8.8766 121.1838 55.7074 33.2314 172.6964 19 T 5.0918 8.7209 123.1068 61.9752 70.3735 173.6721 20 A 4.6526 9.1405 128.6251 50.0373 21.9058 174.5137 21 E 5.0353 8.4471 121.4533 54.6579 31.8821 175.3935 22 F 4.5753 9.0909 122.5441 55.5250 41.7779 174.5361 23 K 5.6460 9.5539 122.4414 53.6379 34.8874 177.5173 24 G 3.7202 8.3223 109.1977 45.4376 0.0000 172.4765 25 T 4.6499 7.9718 113.5852 60.7389 71.1372 174.9610 26 F 3.9390 9.2949 123.9302 61.5975 39.3611 177.3324 27 E 3.9493 8.2882 117.5935 59.4202 29.2972 179.4008 28 K 3.9852 8.2812 118.3513 59.2442 32.0884 179.3647 29 A 3.9733 8.1400 121.2617 55.2898 18.3793 179.8091 30 T 3.2466 7.3161 113.7735 66.6927 68.4903 176.7662 31 S 4.1705 7.8239 114.9368 61.5341 62.3876 176.0844 32 E 3.9522 8.3467 121.3704 58.9133 29.1538 179.0927 33 A 2.0000 7.2802 121.0644 54.6749 18.2841 179.3568 34 Y 3.8453 7.1729 114.4724 60.8626 37.6460 178.4140 35 A 4.0927 7.6541 121.2656 55.2503 18.6582 178.7565 36 Y 4.1835 8.0955 117.9384 60.7242 38.8908 177.8670 37 A 4.0201 7.8718 121.7993 55.2564 18.2670 179.3420 38 D 4.7295 8.2721 117.6981 57.8079 40.7084 179.0610 39 T 3.9876 7.5096 108.9721 64.0717 68.9726 175.7619 40 L 4.1837 7.4739 120.3267 55.2890 41.8402 178.4595 41 K 4.6778 7.8147 121.7378 58.9608 31.9504 178.2393 42 K 3.8796 8.1366 118.5233 59.3664 32.1969 176.9784 43 D 4.6017 8.0064 116.3436 55.3989 41.5895 176.6831 44 N 4.8018 8.7668 114.5830 52.4337 39.7950 175.2894 45 G 4.4229 8.6314 105.5248 44.4415 0.0000 172.7458 46 E 4.5055 8.5244 116.4906 56.1195 30.6643 175.9660 47 W 5.1700 8.1447 117.8367 55.1122 31.1593 174.9120 48 T 4.8271 8.8330 117.2035 61.7412 71.9001 173.3268 49 V 5.0822 8.6771 124.4743 60.0394 34.5399 174.6080 50 D 4.9111 8.9097 122.5288 52.5982 43.8785 175.1454 51 V 4.5938 8.5931 123.7186 62.4180 32.9750 174.5522 52 A 4.7048 8.8668 127.8073 49.7619 23.5903 174.9607 53 D 4.4690 9.2066 115.3037 56.6182 38.2397 174.5403 54 K 3.9873 9.3628 109.0475 57.4407 30.2023 177.0716 55 G 4.0819 8.2816 107.0292 45.6267 0.0000 174.8549 56 Y 4.1664 8.3820 116.7929 59.1413 38.5768 174.8476 57 T 5.1009 7.8239 117.0451 61.5199 72.3440 172.6795 58 L 4.8114 9.1660 126.4606 53.1202 44.7118 175.7326 59 N 5.0050 9.0456 123.5365 52.2162 39.5020 174.2473 60 I 4.7592 8.3738 126.0946 59.4732 39.1521 174.7719 61 K 4.9757 8.9167 129.5349 54.6173 33.3951 174.6664 62 F 5.2293 9.1543 125.9183 55.8340 40.4935 176.8893 63 A 4.0795 9.1937 126.1337 53.0147 18.9827 177.8301 64 G 4.1060 8.3576 109.1300 45.9861 0.0000 173.3191 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 -7 M 8.30 4.25 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 -6 H 8.46 3.86 0.00 3.31 3.16 0.00 5.80 0.00 0.00 0.00 0.00 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -5 H 8.27 3.98 0.00 3.05 3.28 0.00 5.90 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 -4 H 8.25 4.58 0.00 2.90 2.98 0.00 5.97 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 H 8.51 4.44 0.00 3.15 3.17 0.00 5.75 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 8.37 4.72 0.00 3.07 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.84 4.68 0.00 3.21 3.10 0.00 5.89 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 0 A 8.88 3.96 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 1 M 7.89 4.40 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 2 E 8.33 4.20 0.00 2.12 2.20 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 2.47 2.43 0.00 3 E 8.80 5.05 0.00 1.85 1.92 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 2.39 2.26 0.00 4 V 9.33 4.77 2.53 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 0.99 0.00 0.00 1.16 0.00 0.00 5 T 8.66 5.08 4.31 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 1.23 0.00 0.00 6 I 8.96 4.53 1.81 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.60 0.66 0.00 0.00 7 K 9.24 4.55 0.00 1.72 1.78 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.45 7.81 8 A 9.17 4.92 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 9 N 9.07 4.90 0.00 2.81 2.81 0.00 0.00 6.69 7.25 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 10 L 9.21 4.73 0.00 1.62 1.28 1.26 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.81 4.63 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.94 0.00 0.00 12 F 8.88 5.09 0.00 3.06 2.98 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 13 A 8.27 4.09 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.30 4.62 0.00 2.88 2.96 0.00 0.00 6.02 7.26 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 15 A 8.48 3.85 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 0.00 0.00 0.00 0.00 0.00 16 S 8.65 4.52 0.00 4.08 4.08 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 17 T 7.98 5.38 4.30 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 1.31 0.00 0.00 18 Q 8.88 4.60 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 19 T 8.72 5.09 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 20 A 9.14 4.65 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.45 5.04 0.00 1.70 1.80 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 2.20 2.25 0.00 22 F 9.09 4.58 0.00 2.89 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 23 K 9.55 5.65 0.00 1.59 1.70 0.00 1.80 0.00 0.00 2.34 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.21 7.81 24 G 8.32 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 0.00 0.00 0.00 25 T 7.97 4.65 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 26 F 9.29 3.94 0.00 3.11 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 27 E 8.29 3.95 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 28 K 8.28 3.99 0.00 1.87 1.86 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 29 A 8.14 3.97 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.32 3.25 4.09 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 1.02 0.00 0.00 31 S 7.82 4.17 0.00 3.95 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.35 3.95 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 33 A 7.28 2.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.17 3.85 0.00 3.14 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 35 A 7.65 4.09 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.10 4.18 0.00 3.26 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 37 A 7.87 4.02 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.27 4.73 0.00 3.05 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 39 T 7.51 3.99 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 40 L 7.47 4.18 0.00 1.59 1.36 0.80 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.81 4.68 0.00 2.11 2.04 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.77 1.58 7.81 42 K 8.14 3.88 0.00 1.77 1.85 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 43 D 8.01 4.60 0.00 2.63 2.64 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 0.00 0.00 0.00 44 N 8.77 4.80 0.00 2.65 2.89 0.00 0.00 6.97 8.17 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 45 G 8.63 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.52 4.51 0.00 1.92 2.06 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 2.36 2.27 0.00 47 W 8.14 5.17 0.00 2.69 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 0.00 0.00 0.00 0.00 48 T 8.83 4.83 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 1.20 0.00 0.00 49 V 8.68 5.08 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 0.95 0.00 0.00 1.09 0.00 0.00 50 D 8.91 4.91 0.00 2.61 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.59 4.59 2.17 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 0.84 0.00 0.00 1.05 0.00 0.00 52 A 8.87 4.70 1.24 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 0.00 0.00 0.00 53 D 9.21 4.47 0.00 2.95 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 54 K 9.36 3.99 0.00 2.03 1.92 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.48 7.81 55 G 8.28 4.08 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 0.00 0.00 0.00 56 Y 8.38 4.17 0.00 3.31 3.11 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 0.00 0.00 0.00 0.00 57 T 7.82 5.10 4.45 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 1.24 0.00 0.00 58 L 9.17 4.81 0.00 1.34 1.44 0.19 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 59 N 9.05 5.00 0.00 2.82 2.79 0.00 0.00 6.50 7.00 0.00 0.00 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 I 8.37 4.76 1.69 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.65 0.26 0.00 0.00 61 K 8.92 4.98 0.00 1.77 1.61 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.54 7.81 62 F 9.15 5.23 0.00 3.15 3.36 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 63 A 9.19 4.08 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 64 G 8.36 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00