NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 K 4.3548 8.1733 122.1401 55.5691 34.9238 175.4202 0 L 3.3607 8.1941 122.7068 54.8815 41.2793 178.2074 1 C 4.4500 9.5785 131.7234 60.4646 40.8396 175.0038 2 S 3.9813 7.9866 114.7326 59.6364 62.8874 173.9088 3 L 4.3002 7.8807 123.2107 53.7385 41.4991 175.4608 4 D 4.2158 9.2549 128.9810 55.3875 39.8329 173.3092 5 N 4.0584 8.2616 109.6033 53.3750 37.5906 174.2189 6 G 3.6269 8.8556 101.3306 45.7740 0.0000 174.7878 7 D 4.5898 8.1573 115.9854 54.1795 40.5535 173.6223 8 C 4.5713 7.8507 114.9056 57.1783 40.8785 173.7337 9 D 4.5107 8.4714 123.4899 56.9953 42.0810 177.2625 10 Q 4.5075 7.4534 112.2723 55.7663 30.6886 179.4011 11 F 4.7101 6.7952 128.1325 58.5612 40.1316 172.5870 12 C 5.5473 8.9084 122.3514 55.0870 41.8872 172.4182 13 H 5.0004 9.2746 124.8545 54.4813 33.2526 171.5190 14 E 4.9737 8.5598 124.6822 55.0461 31.0430 175.3585 15 E 4.4919 9.2665 124.5514 55.6396 32.7509 175.8132 16 Q 3.3881 9.6110 123.0867 57.7831 25.9219 172.8555 17 N 4.2267 8.0168 108.9480 53.9210 38.3968 173.2538 18 S 4.6118 7.7771 108.0172 56.0232 65.8104 172.6717 19 V 4.3702 8.2605 126.7499 62.5269 32.4674 175.1236 20 V 4.4472 9.2001 127.4288 61.4301 34.0136 173.6777 21 C 5.4474 8.8850 125.2303 56.0930 37.4188 172.6797 22 S 4.6955 8.6725 115.1905 57.8373 66.6930 171.7523 23 C 4.7744 8.4536 115.5712 54.4966 38.9359 174.2906 24 A 4.3790 8.7021 124.0046 51.7530 18.6757 177.3091 25 R 4.0619 8.4084 120.2466 57.9488 30.6967 176.9230 26 G 4.0059 9.4630 112.7984 45.0974 0.0000 171.9015 27 Y 5.2633 7.6040 116.2152 56.1164 41.5622 175.0760 28 T 4.7560 8.9732 111.8580 59.4687 72.1586 173.0537 29 L 4.5547 8.5281 125.8646 55.0179 42.8757 176.5013 30 A 4.2642 9.0805 128.4654 51.6189 19.3690 177.9987 31 D 4.2906 8.8607 119.0744 57.6603 40.8618 178.1178 32 N 4.4321 8.1618 113.4123 53.0436 37.5290 175.5057 33 G 3.9821 8.2801 107.0044 46.3473 0.0000 173.9488 34 K 4.4796 8.4940 118.0327 57.6590 35.2556 176.8778 35 A 4.6230 8.2384 120.6369 51.9233 20.0758 176.6582 36 C 5.3402 8.7524 117.0790 55.2430 39.0441 173.6859 37 I 4.6768 8.7907 125.3179 58.6576 39.3429 173.5445 38 P 4.0722 0.0000 0.0000 62.9049 31.1535 176.8271 39 T 3.9681 8.5046 121.9399 66.4645 69.0702 174.4228 40 G 4.0137 7.3233 106.8357 43.8340 0.0000 170.1652 41 P 4.0668 0.0000 0.0000 63.5028 32.2912 175.8006 42 Y 3.5718 7.5974 116.4538 58.5698 35.1581 169.2545 43 P 4.3657 0.0000 0.0000 62.1080 32.4603 176.6700 44 C 4.2012 8.4337 114.5006 59.7965 29.9566 174.8683 45 G 3.9708 8.9229 109.0784 45.6200 0.0000 173.1752 46 K 4.6085 7.2805 118.9201 54.2242 33.8358 176.5353 47 Q 4.2106 8.5520 122.7991 56.0191 29.3896 175.8679 48 T 4.4634 8.2945 111.5887 61.1201 70.0083 174.5320 49 L 4.7337 8.0714 121.8661 54.0842 43.5367 176.1361 50 E 4.3999 8.0351 124.8801 56.8758 29.4271 174.8699 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 -1 K 8.17 4.35 0.00 1.70 1.76 0.00 1.90 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.04 7.81 0 L 8.19 3.36 0.00 2.06 0.71 0.89 0.68 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 1 C 9.58 4.45 0.00 3.16 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 2 S 7.99 3.98 0.00 4.03 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 3 L 7.88 4.30 0.00 1.72 1.72 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 4 D 9.25 4.22 0.00 2.90 2.62 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 5 N 8.26 4.06 0.00 3.00 2.81 0.00 0.00 7.56 7.92 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 6 G 8.86 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.16 4.59 0.00 2.84 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 8 C 7.85 4.57 0.00 3.08 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 9 D 8.47 4.51 0.00 2.70 2.58 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 0.00 10 Q 7.45 4.51 0.00 1.50 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.94 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 11 F 6.80 4.71 0.00 2.94 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 12 C 8.91 5.55 0.00 3.06 2.95 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 13 H 9.27 5.00 0.00 3.21 3.08 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.56 4.97 0.00 1.82 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 2.23 2.30 0.00 15 E 9.27 4.49 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 16 Q 9.61 3.39 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 17 N 8.02 4.23 0.00 2.82 2.85 0.00 0.00 6.99 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.78 4.61 0.00 3.88 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 19 V 8.26 4.37 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 0.81 0.00 0.00 0.94 0.00 0.00 20 V 9.20 4.45 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 1.02 0.00 0.00 0.96 0.00 0.00 21 C 8.89 5.45 0.00 3.03 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 22 S 8.67 4.70 0.00 3.98 4.01 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 23 C 8.45 4.77 0.00 2.78 2.77 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 24 A 8.70 4.38 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 25 R 8.41 4.06 0.00 1.87 1.94 0.00 3.25 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 26 G 9.46 4.01 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 0.00 27 Y 7.60 5.26 0.00 2.82 2.79 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 28 T 8.97 4.76 4.26 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 1.22 0.00 0.00 29 L 8.53 4.55 0.00 1.67 1.62 1.01 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.08 4.26 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.86 4.29 0.00 2.66 2.76 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 32 N 8.16 4.43 0.00 2.81 2.93 0.00 0.00 6.01 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 33 G 8.28 3.98 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 0.00 0.00 0.00 34 K 8.49 4.48 0.00 1.80 1.91 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.49 7.81 35 A 8.24 4.62 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 36 C 8.75 5.34 0.00 2.67 2.85 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 0.00 0.00 0.00 37 I 8.79 4.68 1.89 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 1.25 0.68 0.91 0.00 0.00 38 P 0.00 4.07 0.00 1.73 1.54 0.00 3.66 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.06 0.00 39 T 8.50 3.97 4.16 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 1.18 0.00 0.00 40 G 7.32 4.01 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 0.00 41 P 0.00 4.07 0.00 2.14 1.87 0.00 3.82 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 42 Y 7.60 3.57 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.37 0.00 1.76 1.61 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.78 0.00 44 C 8.43 4.20 0.00 3.22 3.20 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 45 G 8.92 3.97 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 0.00 0.00 0.00 46 K 7.28 4.61 0.00 1.73 1.77 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.60 7.81 47 Q 8.55 4.21 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 48 T 8.29 4.46 4.43 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 1.40 0.00 0.00 49 L 8.07 4.73 0.00 1.61 1.69 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.04 4.40 0.00 1.87 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 2.14 2.24 0.00