NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3000 8.1127 119.7036 56.2884 31.5468 173.8731 5 E 4.5426 8.1248 119.7684 53.7918 33.1683 172.6841 6 C 4.3741 9.5987 125.0698 58.4734 32.5657 173.1687 7 D 4.3205 8.2516 128.5328 57.8689 39.9574 177.9961 8 Y 4.4465 7.2178 118.6877 60.5697 39.7083 176.6758 9 C 3.9025 7.9915 113.7075 60.1930 30.1944 175.7026 10 G 3.9418 8.2377 106.4619 44.6226 0.0000 172.6855 11 T 4.5899 7.5035 110.0415 59.8041 71.2520 173.8270 12 D 4.7120 8.6047 124.6894 54.5885 41.3071 176.2200 13 I 4.1013 7.6554 122.1684 60.6314 38.6116 175.6373 14 E 3.9991 8.7120 126.7200 54.6760 29.6431 173.5905 15 P 4.0525 0.0000 0.0000 67.2954 30.7743 175.2296 16 G 4.1727 8.7280 112.2488 45.5437 0.0000 172.3345 17 T 4.5860 7.9727 114.8714 62.5094 72.6016 174.5582 18 G 4.0477 8.9753 108.9290 45.8962 0.0000 172.5544 19 T 4.6995 8.5705 116.1990 62.3171 72.0867 173.5973 20 M 4.9838 8.4488 121.9661 55.2369 34.3223 173.7441 21 F 5.2153 9.7429 130.0560 57.3968 41.8364 174.6592 22 V 4.4730 7.4286 122.7593 61.1845 32.9839 175.1190 23 H 4.1760 8.1795 125.9098 54.7320 29.7615 176.3128 24 K 3.9387 8.6556 121.0597 59.9815 32.0226 177.6798 25 D 4.4008 8.1284 116.5594 56.2328 39.5156 176.7196 26 G 3.8062 7.0130 116.3431 44.7620 0.0000 172.5561 27 A 3.8948 7.6274 123.9921 53.0323 19.3780 176.8982 28 T 4.4937 8.4422 120.0305 63.4419 69.4787 174.5264 29 T 4.6237 8.4346 123.8949 61.0930 70.1265 173.5369 30 H 5.1403 8.4757 123.5137 55.0908 31.0387 174.4396 31 F 5.1245 8.7367 119.9604 55.9276 41.8543 175.8606 32 C 4.2266 9.2329 119.9822 60.7345 29.9480 173.4812 33 S 4.6941 7.7046 112.7001 56.4870 65.4137 174.6905 34 S 4.3879 8.5930 114.5172 60.6615 62.3274 175.8127 35 K 3.9252 8.0675 120.5279 59.7722 32.1603 177.4271 36 C 4.4802 8.1884 115.8302 62.8665 28.8798 175.9241 37 E 3.9446 8.1820 118.0624 59.6373 29.0263 178.4789 38 N 5.0458 7.6246 113.6914 54.1584 38.6740 175.9393 39 N 4.9725 8.3371 117.1720 54.5664 40.9620 177.1015 40 A 4.3912 7.8128 118.1892 53.7078 18.7769 177.7350 41 D 4.7650 8.0694 113.5832 54.9295 40.9346 176.2866 42 L 4.7901 7.1440 118.9628 54.1369 43.1996 178.4599 43 G 3.4787 8.0584 109.0099 45.0693 0.0000 176.5765 44 R 3.4920 7.8825 110.8102 56.2852 28.7892 175.4437 45 E 4.7056 8.2349 125.0402 54.0974 32.1702 176.6206 46 A 4.0116 8.9667 125.0313 55.6905 18.5243 179.6126 47 R 4.0694 7.9126 113.0212 59.2095 30.6035 177.9442 48 N 4.4258 8.2062 114.4043 56.0182 38.7288 175.4641 49 L 4.2062 7.0911 116.5985 53.7510 42.0738 176.5266 50 E 4.0199 8.7507 123.8907 59.3797 29.6069 179.3195 51 W 4.4234 8.0646 114.4279 58.7995 28.4962 176.4465 52 T 3.6907 6.7833 117.1884 63.0253 68.2489 174.8662 53 D 4.5429 8.8193 125.7312 57.7427 41.5520 177.8692 54 T 3.9444 7.4467 114.2708 66.5962 68.6076 175.7344 55 A 4.0280 7.9689 122.7491 54.7207 18.7221 177.3253 56 R 4.2068 8.2071 115.8853 56.2615 29.7265 176.1026 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 4 R 8.11 4.30 0.00 1.83 1.87 0.00 3.06 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 5 E 8.12 4.54 0.00 2.08 1.75 0.00 0.00 0.00 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 2.45 0.00 6 C 9.60 4.37 0.00 3.05 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 4.32 0.00 2.84 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 8 Y 7.22 4.45 0.00 2.74 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 9 C 7.99 3.90 0.00 3.12 3.06 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 0.00 0.00 0.00 10 G 8.24 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.50 4.59 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 1.24 0.00 0.00 12 D 8.60 4.71 0.00 2.59 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 13 I 7.66 4.10 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.56 0.98 0.00 0.00 14 E 8.71 4.00 0.00 2.05 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 2.38 2.36 0.00 15 P 0.00 4.05 0.00 2.21 2.11 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 16 G 8.73 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 17 T 7.97 4.59 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 1.24 0.00 0.00 18 G 8.98 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 19 T 8.57 4.70 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 20 M 8.45 4.98 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 21 F 9.74 5.22 0.00 3.40 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 22 V 7.43 4.47 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 0.82 0.00 0.00 0.90 0.00 0.00 23 H 8.18 4.18 0.00 3.12 3.18 0.00 5.69 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.66 3.94 0.00 1.67 1.82 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.49 7.81 25 D 8.13 4.40 0.00 2.80 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 26 G 7.01 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 0.00 0.00 0.00 27 A 7.63 3.89 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 28 T 8.44 4.49 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 1.07 0.00 0.00 29 T 8.43 4.62 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 0.91 0.00 0.00 30 H 8.48 5.14 0.00 3.08 3.19 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.74 5.12 0.00 3.08 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 32 C 9.23 4.23 0.00 3.13 3.12 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 33 S 7.70 4.69 0.00 3.99 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 34 S 8.59 4.39 0.00 3.86 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.07 3.93 0.00 1.71 1.81 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.15 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.34 1.34 7.81 36 C 8.19 4.48 0.00 3.23 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 37 E 8.18 3.94 0.00 2.10 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.60 0.00 38 N 7.62 5.05 0.00 2.71 2.83 0.00 0.00 6.92 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 39 N 8.34 4.97 0.00 3.36 3.19 0.00 0.00 6.97 7.75 0.00 0.00 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 A 7.81 4.39 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 41 D 8.07 4.77 0.00 2.67 2.68 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 42 L 7.14 4.79 0.00 1.82 1.64 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.06 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.88 3.49 0.00 2.27 2.40 0.00 3.49 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 45 E 8.23 4.71 0.00 2.00 1.83 0.00 0.00 0.00 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 2.25 0.00 46 A 8.97 4.01 1.43 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 47 R 7.91 4.07 0.00 1.79 1.98 0.00 3.21 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 48 N 8.21 4.43 0.00 2.84 2.86 0.00 0.00 6.92 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 49 L 7.09 4.21 0.00 1.23 0.88 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.75 4.02 0.00 2.10 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 2.40 2.33 0.00 51 W 8.06 4.42 0.00 3.47 3.22 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 0.00 52 T 6.78 3.69 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 0.96 0.00 0.00 53 D 8.82 4.54 0.00 2.64 2.86 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 54 T 7.45 3.94 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 1.19 0.00 0.00 55 A 7.97 4.03 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 56 R 8.21 4.21 0.00 1.89 1.92 0.00 3.15 0.00 0.00 3.45 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.58 0.00