NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.2196 8.3149 120.1298 56.4257 32.9658 175.2466 7 E 4.2332 8.4503 126.2762 56.6032 31.4574 173.7458 8 L 5.2729 9.1566 120.8147 53.2133 45.7628 176.0329 9 V 4.9695 9.2332 115.8009 59.5178 35.8710 174.1234 10 L 5.1002 8.9930 125.7724 53.2758 44.2335 175.2542 11 A 4.5401 8.9765 129.3369 52.1452 18.7249 177.9760 12 L 4.1927 8.9620 123.7448 56.6471 42.5441 176.3628 13 Y 4.8741 7.4482 113.8492 56.2280 42.3941 174.4771 14 D 4.9161 8.7398 120.4238 54.7983 42.5247 175.9800 15 Y 4.4851 8.8427 118.0957 57.2932 42.5432 172.5493 16 Q 4.6846 8.2843 129.2652 54.2305 30.2961 174.8925 17 E 4.1757 8.4399 124.7576 57.0907 29.8471 177.1783 18 K 4.6186 9.8561 120.6965 55.7846 33.7379 175.9359 19 S 4.6562 7.6230 112.5925 56.2082 65.6208 173.0973 20 P 4.2046 0.0000 0.0000 65.8173 31.2962 177.6703 21 R 4.2738 7.7398 111.6264 56.8538 29.9574 175.9873 22 E 5.2840 7.9437 119.2157 55.8556 31.0297 175.6860 23 V 4.7074 8.5223 119.3952 60.5832 34.7104 175.0941 24 T 5.1182 8.5760 118.2437 62.7969 70.1613 173.9992 25 M 5.0056 9.3563 121.5759 53.9401 35.3170 173.7183 26 K 5.0472 8.9359 119.3280 54.0451 35.3760 175.9102 27 K 3.9372 9.9684 125.5658 58.5902 32.3732 177.2021 28 G 3.9929 9.1764 114.8869 45.0782 0.0000 173.4810 29 D 4.4604 8.1940 120.6320 54.7704 42.1285 175.8495 30 I 4.7124 8.3808 123.4951 60.0883 38.1108 174.7879 31 L 4.7490 9.0004 128.0611 53.2062 44.6739 176.3075 32 T 4.5393 8.0877 118.9764 62.7854 69.6211 173.8712 33 L 4.2684 8.6306 130.4217 55.1493 41.8845 176.2549 34 L 4.3828 9.0408 127.3988 56.5862 43.1367 177.2818 35 N 4.8281 7.7278 117.3995 51.9610 42.3458 174.9798 36 S 4.3489 8.2371 121.3754 57.8923 63.5452 175.4071 37 T 3.9743 8.1373 113.6557 64.7620 68.9455 173.8985 38 N 4.8599 8.0641 120.1162 51.9161 40.0686 174.7418 39 K 4.2736 8.8651 126.1552 58.9889 32.7568 176.9492 40 D 4.4900 9.0129 118.0576 54.1403 42.9720 176.6696 41 W 5.3948 8.4742 117.0943 54.5530 32.7990 174.7198 42 W 5.4118 9.0864 124.2138 54.7937 31.9111 174.8677 43 K 4.0710 8.9769 126.6089 56.2248 33.0389 175.7986 44 T 5.5692 8.8707 116.4353 59.4001 73.0303 171.9040 45 E 5.0772 8.6646 121.2044 54.4598 32.6570 174.1682 46 V 4.3424 8.6318 127.5937 62.6146 34.5076 176.2926 47 N 3.9684 8.9379 121.4514 53.4596 34.9579 174.1866 48 G 4.0468 9.6040 114.4601 45.7061 0.0000 171.0520 49 R 4.7423 8.3657 115.8177 54.9485 33.0201 174.5399 50 Q 5.5727 8.4925 119.8542 53.5768 31.0099 175.0485 51 G 4.2331 7.8224 109.3690 46.4504 0.0000 171.3428 52 F 5.8761 8.5080 118.7581 56.2657 41.1589 175.7294 53 V 4.9898 8.4681 112.2675 59.0692 36.7946 173.0072 54 P 3.0116 0.0000 0.0000 61.9522 31.4483 177.1954 55 A 2.7190 7.8376 127.7595 54.8224 18.0950 179.2805 56 A 3.8730 7.0431 116.3713 54.6182 18.7412 177.4503 57 Y 4.9979 7.8083 113.6813 58.0683 38.0775 175.1579 58 V 5.0495 7.3678 111.9438 59.5477 36.2212 174.6116 59 K 4.7271 8.9156 123.8050 54.4342 35.2414 175.3687 60 K 4.4445 8.9130 126.3171 56.3761 32.7902 177.6560 61 L 4.7259 8.5074 126.0722 53.0583 40.4381 176.4679 62 D 4.4773 7.9913 121.1404 53.2917 39.7330 177.4162 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 K 8.31 4.22 0.00 1.78 1.66 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.37 7.81 7 E 8.45 4.23 0.00 1.94 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 2.35 2.34 0.00 8 L 9.16 5.27 0.00 1.56 1.53 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 9 V 9.23 4.97 2.23 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 0.88 0.00 0.00 1.08 0.00 0.00 10 L 8.99 5.10 0.00 1.71 1.52 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.98 4.54 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 12 L 8.96 4.19 0.00 1.07 0.86 0.86 0.59 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 13 Y 7.45 4.87 0.00 2.53 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 14 D 8.74 4.92 0.00 2.62 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 15 Y 8.84 4.49 0.00 3.26 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 Q 8.28 4.68 0.00 2.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.61 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 17 E 8.44 4.18 0.00 2.07 2.01 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 2.34 2.36 0.00 18 K 9.86 4.62 0.00 1.76 1.83 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.25 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.28 1.29 7.81 19 S 7.62 4.66 0.00 3.86 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.20 0.00 2.04 2.18 0.00 3.62 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 21 R 7.74 4.27 0.00 2.10 2.14 0.00 2.23 0.00 0.00 2.96 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 22 E 7.94 5.28 0.00 2.17 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 0.00 2.66 2.17 0.00 23 V 8.52 4.71 2.18 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 0.89 0.00 0.00 1.06 0.00 0.00 24 T 8.58 5.12 4.29 0.00 0.00 0.00 0.00 0.00 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 25 M 9.36 5.01 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.77 0.00 26 K 8.94 5.05 0.00 1.76 1.75 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.38 7.81 27 K 9.97 3.94 0.00 1.68 1.74 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 28 G 9.18 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.19 4.46 0.00 2.91 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 30 I 8.38 4.71 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 1.35 0.83 0.92 0.00 0.00 31 L 9.00 4.75 0.00 1.60 1.60 1.00 0.69 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 32 T 8.09 4.54 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 33 L 8.63 4.27 0.00 1.63 1.52 0.94 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 34 L 9.04 4.38 0.00 1.53 1.62 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 35 N 7.73 4.83 0.00 2.75 2.59 0.00 0.00 6.71 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 36 S 8.24 4.35 0.00 2.72 2.63 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 37 T 8.14 3.97 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 1.26 0.00 0.00 38 N 8.06 4.86 0.00 2.86 3.27 0.00 0.00 6.92 6.68 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 39 K 8.87 4.27 0.00 1.82 1.86 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.51 7.81 40 D 9.01 4.49 0.00 2.63 2.27 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 0.00 41 W 8.47 5.39 0.00 3.10 3.28 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 0.00 42 W 9.09 5.41 0.00 3.28 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 43 K 8.98 4.07 0.00 1.14 1.45 0.00 1.38 0.00 0.00 1.52 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.93 0.21 7.81 44 T 8.87 5.57 4.34 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 1.38 0.00 0.00 45 E 8.66 5.08 0.00 2.00 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 2.26 2.26 0.00 46 V 8.63 4.34 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 0.88 0.00 0.00 0.99 0.00 0.00 47 N 8.94 3.97 0.00 2.96 3.20 0.00 0.00 6.39 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 48 G 9.60 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.37 4.74 0.00 1.81 1.99 0.00 2.79 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 50 Q 8.49 5.57 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.24 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 51 G 7.82 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 52 F 8.51 5.88 0.00 3.13 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.47 4.99 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 0.98 0.00 0.00 1.09 0.00 0.00 54 P 0.00 3.01 0.00 0.49 0.49 0.00 2.66 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.65 0.00 55 A 7.84 2.72 -0.17 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 56 A 7.04 3.87 1.07 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 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.81 5.00 0.00 2.88 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 58 V 7.37 5.05 2.16 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 0.67 0.00 0.00 0.90 0.00 0.00 59 K 8.92 4.73 0.00 1.77 1.62 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.40 7.81 60 K 8.91 4.44 0.00 1.76 1.77 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.24 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.75 7.81 61 L 8.51 4.73 0.00 1.58 1.61 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 62 D 7.99 4.48 0.00 2.75 2.63 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