NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.2134 8.3444 119.6857 55.8082 30.8424 175.0230 16 L 3.8032 7.7810 120.7872 53.7749 42.1121 170.9585 17 V 3.9736 8.9858 128.2618 61.2206 32.3752 175.1853 18 I 4.0096 8.1462 129.4861 61.1954 36.4462 175.9967 19 Q 4.3858 8.7714 126.6364 58.3633 29.4315 176.1358 20 E 4.7703 7.9555 114.8637 55.5045 33.7934 174.9735 21 S 4.8755 8.4134 115.9020 57.9691 66.0770 173.7514 22 I 4.4156 8.4173 126.7739 59.4075 39.3466 174.8933 23 L 4.7723 8.4298 128.7038 54.6997 42.9800 175.5717 24 M 5.0346 9.2896 125.7747 53.4427 36.2006 175.4788 25 L 4.4215 9.1714 122.6732 53.5635 43.0592 176.1883 26 P 4.0684 0.0000 0.0000 66.0871 31.2545 178.3731 27 E 3.9376 8.2148 116.3406 59.8617 28.2512 179.1967 28 E 3.9748 8.1998 117.6182 59.4727 29.4457 179.6850 29 V 3.5944 7.6719 117.6579 66.1343 31.7035 177.5086 30 E 4.7951 8.4016 120.7246 58.9271 29.0868 178.4902 31 E 4.1059 8.0283 117.8182 58.2842 29.6596 177.9649 32 V 4.1451 6.8534 113.8508 64.8348 32.7239 177.5076 33 I 3.9645 8.3868 118.7400 62.5375 37.1136 177.2086 34 G 4.0726 8.8439 107.9059 44.7947 0.0000 172.9280 35 N 5.1080 7.9742 115.9095 51.1951 41.5047 172.9798 36 K 4.8097 8.4653 121.6349 53.8129 34.1294 174.1927 37 P 3.8393 0.0000 0.0000 62.9162 31.8199 177.4832 38 E 4.0181 8.6754 115.8126 55.8322 29.2887 173.4882 39 S 4.6271 7.0133 113.0404 59.0959 66.6003 176.4430 40 D 4.6324 8.7748 119.1604 55.2891 41.2770 176.5756 41 I 4.7460 8.9170 121.2106 59.5152 41.5619 174.4611 42 L 4.8329 9.2606 126.1696 53.2213 44.0054 176.0075 43 V 4.1397 9.0389 126.1754 61.9202 32.2192 174.3505 44 H 4.9082 9.0991 126.6803 55.2415 29.8135 174.4760 45 T 5.0667 8.7848 121.0060 61.7437 71.0768 173.8591 46 A 5.1300 8.6804 126.9045 50.3502 21.9802 174.4809 47 Y 5.3020 9.2224 123.8627 56.1818 41.4169 174.8452 48 D 4.5314 8.6054 125.7369 52.9440 42.8431 176.6373 49 E 3.4097 8.7068 122.9716 58.7013 29.3615 175.6929 50 S 4.1025 7.4237 114.7381 60.8224 63.1361 175.2260 51 T 3.8813 7.9077 114.9268 61.3830 69.6813 173.7451 52 D 4.6691 7.3159 120.8441 54.8119 40.2270 172.2404 53 E 5.0147 7.7389 119.0223 54.5675 33.9478 175.0124 54 N 4.9299 9.0273 122.7787 51.6835 41.3432 173.8609 55 V 4.3343 8.4483 125.3660 61.9573 32.9525 174.4244 56 M 5.1613 9.1907 128.7141 53.4308 34.8902 174.8696 57 L 4.8758 8.8799 125.4387 53.3532 44.7360 174.8908 58 L 5.2680 8.8061 127.7780 54.2126 43.3561 176.3094 59 T 5.4580 8.8632 112.9449 59.8022 73.0619 173.4248 60 S 4.7398 8.9536 117.0878 57.9835 64.5214 173.2010 61 D 4.7834 8.7068 120.7027 54.1674 42.1958 175.6189 62 A 2.8068 8.3653 123.9546 51.4684 18.7960 175.6037 63 P 4.0116 0.0000 0.0000 62.9753 31.7809 176.9302 64 E 4.0997 7.7541 116.2204 57.2451 30.2329 180.3511 65 Y 4.6776 6.9359 114.4379 57.5709 36.3797 171.3094 66 K 4.2370 7.8940 120.3224 55.6223 33.5169 174.5366 67 P 4.5779 0.0000 0.0000 63.6775 31.5476 174.4538 68 W 4.8129 9.5954 131.9286 58.4770 33.1822 174.6976 69 A 4.8050 7.8439 118.7502 50.2782 22.9674 173.9292 70 L 5.1616 8.8542 120.5336 53.4277 45.6885 175.3867 71 V 4.9272 8.9837 125.6255 61.1756 35.0165 173.9850 72 I 5.0143 8.6153 127.7710 59.5578 40.4848 174.3122 73 Q 5.4356 9.0424 126.4810 53.4855 32.4008 175.0235 74 D 5.1172 8.4127 125.6871 52.5305 42.1442 176.4699 75 S 4.1360 8.8197 113.9993 61.6678 62.8601 174.8513 76 N 4.7036 8.4366 114.7583 52.4902 37.1716 175.4945 77 G 3.8797 8.1324 108.9166 46.1168 0.0000 174.0656 78 E 4.2896 8.0994 117.8349 56.1737 30.7716 179.7036 79 N 5.2199 8.7296 121.9046 51.0765 40.9215 175.1669 80 K 4.4603 9.1770 122.1472 54.9046 34.5356 175.1028 81 I 4.8357 8.1750 125.4433 59.8715 39.3229 175.6781 82 K 4.4531 8.4059 126.0438 55.4511 35.5579 175.2617 83 M 4.2355 8.6024 127.0620 54.9582 33.2318 176.3411 84 L 4.3173 8.2587 120.9554 54.8846 41.7327 176.4820 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 15 Q 8.34 4.21 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 16 L 7.78 3.80 0.00 1.68 1.59 0.93 0.60 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 17 V 8.99 3.97 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 0.88 0.00 0.00 0.95 0.00 0.00 18 I 8.15 4.01 1.86 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.89 0.98 0.00 0.00 19 Q 8.77 4.39 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 20 E 7.96 4.77 0.00 1.98 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 2.26 2.33 0.00 21 S 8.41 4.88 0.00 3.72 3.70 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 0.00 0.00 0.00 0.00 22 I 8.42 4.42 1.86 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 1.17 1.09 0.90 0.00 0.00 23 L 8.43 4.77 0.00 1.63 1.56 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 24 M 9.29 5.03 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.69 0.00 25 L 9.17 4.42 0.00 1.65 1.53 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.07 0.00 2.08 2.22 0.00 3.56 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 2.04 2.22 0.00 27 E 8.21 3.94 0.00 2.03 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 2.40 2.48 0.00 28 E 8.20 3.97 0.00 2.18 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 2.40 2.37 0.00 29 V 7.67 3.59 2.11 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 1.15 0.00 0.00 0.88 0.00 0.00 30 E 8.40 4.80 0.00 2.09 2.12 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 2.35 2.25 0.00 31 E 8.03 4.11 0.00 2.16 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 2.34 2.33 0.00 32 V 6.85 4.15 2.14 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 0.95 0.00 0.00 1.02 0.00 0.00 33 I 8.39 3.96 2.12 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.33 0.82 0.00 0.00 34 G 8.84 4.07 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 0.00 35 N 7.97 5.11 0.00 2.90 2.90 0.00 0.00 6.66 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 36 K 8.47 4.81 0.00 1.89 1.72 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.56 7.81 37 P 0.00 3.84 0.00 1.89 0.50 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.26 0.00 38 E 8.68 4.02 0.00 2.01 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 2.23 1.87 0.00 39 S 7.01 4.63 0.00 3.80 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 40 D 8.77 4.63 0.00 2.52 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 41 I 8.92 4.75 1.86 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.71 0.95 0.00 0.00 42 L 9.26 4.83 0.00 1.82 1.47 1.22 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 43 V 9.04 4.14 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 0.98 0.00 0.00 0.96 0.00 0.00 44 H 9.10 4.91 0.00 3.21 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.78 5.07 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 1.21 0.00 0.00 46 A 8.68 5.13 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 47 Y 9.22 5.30 0.00 2.82 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 48 D 8.61 4.53 0.00 2.73 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.71 3.41 0.00 2.02 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 2.24 1.90 0.00 50 S 7.42 4.10 0.00 3.95 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 51 T 7.91 3.88 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 52 D 7.32 4.67 0.00 2.76 2.75 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 0.00 0.00 0.00 53 E 7.74 5.01 0.00 2.08 1.79 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 2.41 2.33 0.00 54 N 9.03 4.93 0.00 2.67 2.71 0.00 0.00 6.63 7.27 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 55 V 8.45 4.33 2.12 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 0.97 0.00 0.00 0.96 0.00 0.00 56 M 9.19 5.16 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 57 L 8.88 4.88 0.00 1.73 1.60 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.81 5.27 0.00 2.13 1.88 1.30 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.86 5.46 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 60 S 8.95 4.74 0.00 3.89 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 61 D 8.71 4.78 0.00 2.77 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 0.00 0.00 0.00 0.00 62 A 8.37 2.81 1.08 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 63 P 0.00 4.01 0.00 2.09 2.04 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 64 E 7.75 4.10 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.89 0.00 65 Y 6.94 4.68 0.00 3.06 2.94 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 66 K 7.89 4.24 0.00 1.92 1.75 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.48 7.81 67 P 0.00 4.58 0.00 2.02 2.04 0.00 3.73 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 68 W 9.60 4.81 0.00 3.45 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.84 4.80 0.62 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 0.00 0.00 70 L 8.85 5.16 0.00 1.69 1.42 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.98 4.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 72 I 8.62 5.01 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 1.11 0.82 0.96 0.00 0.00 73 Q 9.04 5.44 0.00 2.36 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.12 0.00 74 D 8.41 5.12 0.00 2.96 2.84 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 0.00 0.00 0.00 75 S 8.82 4.14 0.00 3.90 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 76 N 8.44 4.70 0.00 2.86 2.90 0.00 0.00 7.24 6.57 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 77 G 8.13 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.10 4.29 0.00 1.80 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 2.24 2.16 0.00 79 N 8.73 5.22 0.00 2.60 2.76 0.00 0.00 6.87 7.61 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 80 K 9.18 4.46 0.00 1.80 1.71 0.00 1.53 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.41 7.81 81 I 8.18 4.84 1.82 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 0.51 0.80 0.00 0.00 82 K 8.41 4.45 0.00 1.73 1.53 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.53 7.81 83 M 8.60 4.24 0.00 1.68 1.82 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 84 L 8.26 4.32 0.00 1.53 1.52 0.99 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00