NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2536 8.3027 121.4641 56.3646 32.0643 175.5725 20 I 4.0050 7.3529 123.3925 57.8046 36.1945 172.3730 21 D 4.9623 7.3158 129.6500 53.6986 44.6795 176.5394 22 Y 4.3735 7.9150 125.1554 59.1496 38.6816 176.9800 23 K 4.0225 7.6862 119.8331 59.3755 33.3007 176.8968 24 D 4.6088 7.5177 120.6756 52.9804 40.6876 176.8072 25 I 3.6756 7.7973 122.2015 64.3848 38.0392 175.9628 26 A 4.0033 7.9921 119.9788 55.8588 18.5597 179.3851 27 T 4.0900 8.2473 113.9333 66.7077 68.4466 177.1098 28 L 4.2638 7.9139 120.8251 57.5234 41.4290 179.2321 29 K 4.0200 7.7515 116.8789 58.6687 31.9998 178.3292 30 N 4.3852 7.8234 116.6193 55.1426 39.3224 175.4428 31 Y 4.6629 7.9399 118.1266 57.5695 38.4941 176.0853 32 I 4.6593 7.4516 120.4761 59.6777 39.8309 175.4489 33 T 3.9899 8.3746 120.8569 61.9128 67.6906 174.4682 34 E 3.9352 8.8170 124.3510 59.5160 29.0625 178.2433 35 S 4.2725 7.4107 115.8446 58.0383 63.3270 174.9427 36 G 4.2138 7.4120 121.7328 45.9621 0.0000 173.3775 37 K 4.3960 7.3372 119.5068 56.4962 34.1316 176.6530 38 I 4.9302 8.1023 114.3489 59.9945 39.0811 175.0177 39 V 4.2541 8.1837 122.8446 60.8497 32.5434 173.9596 40 P 4.4366 0.0000 0.0000 62.8101 31.8876 176.3018 41 S 4.5111 8.4279 111.3998 58.8879 64.0013 176.0981 42 R 4.1312 7.8831 120.5001 58.6353 30.6882 178.1783 43 I 4.0616 7.7579 114.6490 62.8103 37.0005 176.4641 44 T 4.4702 7.6894 108.1767 60.3759 70.8111 175.3285 45 G 3.9442 8.1916 108.8692 45.5825 0.0000 173.7260 46 T 4.1291 7.6046 109.7144 61.0995 69.6053 174.3613 47 R 4.1569 8.3517 121.4382 55.9554 32.0967 177.7255 48 A 3.9024 8.3898 123.1686 55.2198 18.4130 179.8629 49 K 3.7223 7.9211 116.4692 60.1849 32.4023 177.7471 50 Y 4.6082 7.7485 115.9318 60.7675 38.2287 177.1906 51 Q 3.9161 8.4304 120.9496 59.5303 28.8815 178.9151 52 R 3.9628 8.2522 118.9186 59.4444 29.9776 179.0192 53 Q 4.0323 8.2164 117.7590 58.6104 28.7267 177.9635 54 L 4.1983 8.0661 120.7096 57.1221 41.5515 179.0143 55 A 3.9715 7.8904 119.4623 55.6276 18.3632 179.9280 56 R 3.8463 7.7526 116.1602 59.2780 29.9496 179.3011 57 A 4.0914 8.9038 121.7449 55.1807 18.4447 179.6794 58 I 3.6956 8.2227 118.7752 64.4356 37.1018 178.6588 59 K 3.9221 8.2586 119.3726 59.6534 31.7263 179.2724 60 R 3.8620 7.5731 116.1907 59.3643 30.2175 178.4960 61 A 4.2006 7.7918 120.2934 55.2551 18.2932 179.6779 62 R 4.5371 7.7760 117.6973 59.1013 29.8322 179.3732 63 Y 4.7160 7.9539 112.4160 58.0362 37.6957 176.9798 64 L 4.5444 8.0482 117.5683 54.7422 43.9755 175.8679 65 S 3.8360 8.4672 109.8841 59.1884 61.8764 173.0217 66 L 4.3051 8.0738 120.5157 56.8960 42.0465 176.9740 67 L 4.7467 7.4116 117.5685 52.3715 45.7035 173.5495 68 P 4.9230 0.0000 0.0000 62.6176 32.7136 175.9478 69 Y 4.0278 8.7965 117.4782 60.2520 38.5750 176.6480 70 T 4.4384 7.6820 112.5367 60.1840 70.1619 173.5952 71 D 4.4100 8.3877 127.8677 56.5962 41.4279 177.4689 72 R 3.9956 8.1289 118.1068 59.1170 30.0884 175.2339 73 H 4.4365 8.2317 120.9009 56.1296 30.0857 172.5826 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 19 E 8.30 4.25 0.00 1.92 1.70 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 2.03 2.01 0.00 20 I 7.35 4.01 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.00 0.77 0.00 0.00 21 D 7.32 4.96 0.00 2.66 2.42 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 0.00 22 Y 7.92 4.37 0.00 3.13 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.69 4.02 0.00 1.73 1.63 0.00 1.43 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 1.37 7.81 24 D 7.52 4.61 0.00 2.84 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 25 I 7.80 3.68 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.07 0.99 0.00 0.00 26 A 7.99 4.00 1.31 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 27 T 8.25 4.09 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 28 L 7.91 4.26 0.00 1.82 1.80 0.99 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.75 4.02 0.00 1.85 1.87 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.83 7.81 30 N 7.82 4.39 0.00 2.19 2.31 0.00 0.00 6.89 7.40 0.00 0.00 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 Y 7.94 4.66 0.00 3.10 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 32 I 7.45 4.66 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.83 0.99 0.00 0.00 33 T 8.37 3.99 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 1.33 0.00 0.00 34 E 8.82 3.94 0.00 1.99 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 2.32 2.36 0.00 35 S 7.41 4.27 0.00 3.90 3.76 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 36 G 7.41 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 0.00 0.00 0.00 0.00 37 K 7.34 4.40 0.00 1.86 1.97 0.00 1.51 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.45 7.81 38 I 8.10 4.93 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.78 0.91 0.00 0.00 39 V 8.18 4.25 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 0.86 0.00 0.00 0.97 0.00 0.00 40 P 0.00 4.44 0.00 2.10 2.03 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 41 S 8.43 4.51 0.00 4.19 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 0.00 42 R 7.88 4.13 0.00 1.91 2.01 0.00 3.14 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 43 I 7.76 4.06 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.76 0.93 0.00 0.00 44 T 7.69 4.47 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 45 G 8.19 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 46 T 7.60 4.13 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 1.40 0.00 0.00 47 R 8.35 4.16 0.00 1.73 1.68 0.00 3.19 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 48 A 8.39 3.90 1.28 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 0.00 0.00 49 K 7.92 3.72 0.00 1.65 1.64 0.00 1.68 0.00 0.00 1.45 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.57 7.81 50 Y 7.75 4.61 0.00 2.98 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 51 Q 8.43 3.92 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 52 R 8.25 3.96 0.00 1.91 1.98 0.00 3.17 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 53 Q 8.22 4.03 0.00 2.34 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 54 L 8.07 4.20 0.00 1.85 1.55 0.82 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.89 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.85 0.00 1.97 2.00 0.00 3.13 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 57 A 8.90 4.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.22 3.70 2.03 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 1.57 1.15 0.89 0.00 0.00 59 K 8.26 3.92 0.00 2.00 2.04 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.79 7.81 60 R 7.57 3.86 0.00 1.81 1.44 0.00 3.35 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.90 0.00 61 A 7.79 4.20 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.78 4.54 0.00 1.56 0.81 0.00 2.71 0.00 0.00 2.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.61 0.00 63 Y 7.95 4.72 0.00 3.03 3.01 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 64 L 8.05 4.54 0.00 1.83 1.62 0.77 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.47 3.84 0.00 4.12 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.07 4.31 0.00 1.86 1.83 1.15 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.41 4.75 0.00 1.62 1.46 0.95 1.03 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 68 P 0.00 4.92 0.00 2.22 2.08 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 69 Y 8.80 4.03 0.00 2.84 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 70 T 7.68 4.44 4.28 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 1.27 0.00 0.00 71 D 8.39 4.41 0.00 2.87 2.78 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 0.00 0.00 0.00 72 R 8.13 4.00 0.00 1.82 2.01 0.00 3.24 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 73 H 8.23 4.44 0.00 3.12 3.07 0.00 5.84 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