NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.4641 8.0333 111.0753 61.7585 71.0420 172.5205 2 M 4.4399 9.1852 125.0804 54.5745 33.0323 173.4148 3 C 5.2138 9.8754 122.5500 54.7712 45.1773 173.0424 4 Y 5.0832 8.3950 118.2836 58.4783 38.5197 175.6701 5 S 4.6889 8.6053 116.8418 57.4813 66.1027 172.8670 6 H 4.8702 8.2395 121.5389 56.3412 32.4040 171.8387 7 T 5.2004 8.5793 108.5614 60.4197 71.0325 173.4135 8 T 4.0483 8.7443 116.5761 66.6764 68.4996 174.9778 9 T 4.6935 7.6033 110.4816 60.7765 69.1553 173.6525 10 S 4.6790 7.7968 114.1441 57.0662 66.0791 173.7746 11 R 3.9844 8.3445 120.3733 55.9937 30.5187 176.3375 12 A 4.5798 8.1176 122.1716 52.0651 19.2646 177.0888 13 I 4.8177 8.9007 114.4971 58.9523 41.3866 174.9069 14 L 4.6648 8.6411 123.9101 55.6247 42.4926 176.0841 15 T 4.4607 8.4962 114.8010 61.2066 71.4329 172.4029 16 N 4.7509 8.6606 126.0755 52.7586 37.5184 175.0960 17 C 4.3765 8.8907 123.6358 56.7308 41.2428 176.5016 18 G 3.5990 8.5883 105.4704 45.7515 0.0000 176.1634 19 E 3.8866 8.9553 124.0809 58.2330 29.7143 175.4118 20 N 4.3961 8.9564 120.3008 50.9824 36.3522 172.7191 21 S 4.9815 8.5038 110.9841 57.4662 66.8594 173.3866 22 C 5.6982 9.1366 116.8402 55.3631 42.1639 172.8879 23 Y 5.4156 8.2390 117.2152 55.7310 42.0757 174.5658 24 R 4.6745 8.7739 119.8880 54.6128 32.5413 173.4362 25 K 4.9471 9.2039 128.5070 56.1001 33.9130 175.6022 26 S 5.0547 8.6432 120.0803 57.3045 67.2791 173.0038 27 R 4.4064 8.8096 121.3570 56.0876 30.0562 176.6383 28 R 3.9029 9.1664 128.4393 59.4350 30.3349 176.4041 29 H 4.9788 7.8778 113.1128 52.9092 31.0701 172.7188 30 P 4.3964 0.0000 0.0000 62.5237 31.6069 174.7366 31 P 4.4589 0.0000 0.0000 62.3474 32.3048 177.7533 32 K 4.6643 8.2024 123.8582 54.9701 30.7246 176.0902 33 M 4.2546 7.5964 120.9061 54.9436 33.7727 176.7039 34 V 4.1036 8.3729 123.9270 63.1070 31.9431 175.5079 35 L 4.5573 9.8938 127.6834 54.0800 42.6600 176.6378 36 G 4.3070 7.2220 110.2156 45.0519 0.0000 171.5546 37 R 4.5250 6.2751 116.3215 54.3212 34.8658 175.9608 38 G 3.9673 6.1947 105.7402 46.4014 0.0000 171.8971 39 C 5.0406 8.8802 117.9002 56.0916 41.8031 171.9859 40 G 3.6682 8.4427 110.2761 44.4628 0.0000 172.7666 41 C 4.7024 8.3861 118.8614 54.2864 44.3923 171.9834 42 P 4.6555 0.0000 0.0000 60.2393 32.4620 174.6711 43 P 4.3210 0.0000 0.0000 63.2278 32.3684 177.0381 44 G 4.1727 7.8389 110.4735 45.9975 0.0000 170.4795 45 D 4.4021 8.3609 118.5963 54.4420 45.5321 176.4560 46 D 4.5883 9.0619 118.3538 57.5372 41.0933 177.3209 47 N 4.7121 8.1048 115.0433 54.2226 40.9371 175.2352 48 L 4.8708 7.4253 117.7668 53.4455 43.6074 175.4433 49 E 4.8568 9.1752 125.7267 54.3474 31.8779 174.4456 50 V 4.8680 8.4456 126.5699 61.1194 33.8665 174.4370 51 K 4.5997 8.7113 127.3343 55.1709 33.7829 175.0102 52 C 5.4723 8.7149 122.7138 56.0794 42.4710 171.7666 53 C 5.0215 8.5002 114.0950 55.4842 44.5298 174.5059 54 T 4.1874 8.4433 107.1993 63.4566 70.0341 175.3374 55 S 4.2772 7.5843 118.3450 59.8456 63.5419 174.2128 56 P 3.9961 0.0000 0.0000 63.8905 31.4516 173.2053 57 D 4.5437 7.7323 123.0840 54.4837 41.8648 173.6322 58 K 3.6814 8.4875 126.8171 57.8808 31.4519 174.2896 59 C 4.4787 8.1053 115.4268 58.8886 42.3220 174.3487 60 N 4.7400 8.1323 115.4633 53.1867 36.9872 174.2473 61 Y 4.2825 7.8058 124.9076 58.4645 38.7918 175.7324 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 T 8.03 4.46 4.21 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 0.00 0.00 1.33 0.00 0.00 2 M 9.19 4.44 0.00 1.87 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.69 0.00 3 C 9.88 5.21 0.00 2.73 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 4 Y 8.39 5.08 0.00 3.09 2.80 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 0.00 0.00 0.00 5 S 8.61 4.69 0.00 3.86 3.80 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 0.00 0.00 0.00 6 H 8.24 4.87 0.00 3.42 3.49 0.00 5.45 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 7 T 8.58 5.20 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 1.24 0.00 0.00 8 T 8.74 4.05 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 9 T 7.60 4.69 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 1.21 0.00 0.00 10 S 7.80 4.68 0.00 3.94 3.82 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 11 R 8.34 3.98 0.00 1.81 1.88 0.00 3.19 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 12 A 8.12 4.58 1.03 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 0.00 0.00 0.00 0.00 0.00 13 I 8.90 4.82 1.92 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 1.47 0.82 0.94 0.00 0.00 14 L 8.64 4.66 0.00 1.56 1.59 0.54 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.50 4.46 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 1.26 0.00 0.00 16 N 8.66 4.75 0.00 2.74 2.73 0.00 0.00 7.06 7.65 0.00 0.00 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 C 8.89 4.38 0.00 2.99 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 18 G 8.59 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 3.89 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 2.28 2.37 0.00 20 N 8.96 4.40 0.00 2.91 3.34 0.00 0.00 6.14 7.64 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 21 S 8.50 4.98 0.00 4.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.14 5.70 0.00 2.84 2.92 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 0.00 0.00 0.00 23 Y 8.24 5.42 0.00 2.98 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 24 R 8.77 4.67 0.00 1.99 1.85 0.00 3.27 0.00 0.00 3.13 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 25 K 9.20 4.95 0.00 2.12 1.75 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.41 7.81 26 S 8.64 5.05 0.00 4.00 3.93 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 27 R 8.81 4.41 0.00 1.92 2.05 0.00 3.08 0.00 0.00 3.44 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.58 0.00 28 R 9.17 3.90 0.00 1.81 1.79 0.00 3.28 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 29 H 7.88 4.98 0.00 3.18 3.17 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.40 0.00 2.05 2.01 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 31 P 0.00 4.46 0.00 2.04 1.98 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 32 K 8.20 4.66 0.00 1.74 1.77 0.00 1.80 0.00 0.00 0.61 0.00 0.00 3.19 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.56 1.42 7.81 33 M 7.60 4.25 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.63 0.00 34 V 8.37 4.10 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 0.84 0.00 0.00 0.86 0.00 0.00 35 L 9.89 4.56 0.00 1.55 1.71 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 36 G 7.22 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 0.00 0.00 0.00 0.00 37 R 6.28 4.52 0.00 1.56 1.78 0.00 3.26 0.00 0.00 3.55 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.43 0.00 38 G 6.19 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 39 C 8.88 5.04 0.00 3.03 3.07 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 40 G 8.44 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.39 4.70 0.00 2.90 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 42 P 0.00 4.66 0.00 1.88 1.72 0.00 3.29 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.19 0.00 43 P 0.00 4.32 0.00 2.01 2.01 0.00 3.56 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 44 G 7.84 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 45 D 8.36 4.40 0.00 2.56 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.06 4.59 0.00 2.66 2.74 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 0.00 0.00 0.00 47 N 8.10 4.71 0.00 2.64 2.85 0.00 0.00 7.09 6.74 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 48 L 7.43 4.87 0.00 1.63 1.58 0.91 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 49 E 9.18 4.86 0.00 1.98 1.78 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 2.21 2.21 0.00 50 V 8.45 4.87 2.08 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 0.95 0.00 0.00 1.00 0.00 0.00 51 K 8.71 4.60 0.00 1.83 1.75 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.42 7.81 52 C 8.71 5.47 0.00 2.88 3.03 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 0.00 0.00 0.00 53 C 8.50 5.02 0.00 2.99 3.16 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 0.00 54 T 8.44 4.19 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 1.23 0.00 0.00 55 S 7.58 4.28 0.00 3.91 3.86 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 56 P 0.00 4.00 0.00 2.03 2.13 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 57 D 7.73 4.54 0.00 2.78 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 58 K 8.49 3.68 0.00 1.37 1.75 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.25 1.31 7.81 59 C 8.11 4.48 0.00 3.16 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 60 N 8.13 4.74 0.00 2.89 2.97 0.00 0.00 5.97 7.55 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 61 Y 7.81 4.28 0.00 3.39 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