NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1724 7.9133 120.6706 62.9848 33.2457 174.0453 3 D 5.4245 8.6865 127.3961 52.6742 43.6968 173.6350 4 Y 5.1185 9.2788 118.7351 56.3039 42.5730 174.0396 5 I 4.6825 8.6535 122.9970 59.4872 40.4995 174.7023 6 V 4.1387 8.6621 129.6634 63.0147 31.8204 176.0763 7 E 4.2437 9.3895 127.4292 57.1346 31.0582 176.0584 8 Y 4.8487 7.7414 115.4433 55.8753 41.9431 175.0211 9 D 4.8572 9.1373 123.3930 55.2069 41.8281 175.2735 10 Y 4.8691 9.1548 122.6580 55.9735 42.6522 173.3257 11 D 4.9768 7.3639 124.8432 51.8180 43.0356 176.1595 12 A 4.2578 8.2767 126.9995 52.6203 18.9012 177.2161 13 V 4.1631 9.1002 121.1860 62.8731 33.5243 175.3182 14 H 5.0996 7.9035 115.4218 53.5034 31.9620 174.1730 15 D 4.4134 8.8360 121.3790 57.3823 40.9289 177.3575 16 D 4.7556 8.0994 116.4853 53.2884 39.8113 175.2865 17 E 5.1588 7.8951 119.2604 55.6564 31.3303 175.4059 18 L 4.6893 9.0746 122.7269 54.0016 43.2215 176.4621 19 T 4.6644 8.5427 120.7399 62.9099 69.4364 174.1957 20 I 4.8032 8.9640 119.4467 59.1958 41.7069 174.4548 21 R 5.0918 8.7927 121.5895 54.1259 34.2875 174.8689 22 V 3.6426 8.7509 122.2041 64.8425 31.5326 175.9707 23 G 4.0339 8.8488 116.5855 45.1896 0.0000 173.5300 24 E 4.1968 8.1912 119.4648 56.4554 30.8439 175.9464 25 I 4.7292 8.1733 123.4276 59.9885 38.9073 175.1221 26 I 4.4894 8.6901 129.0677 60.2852 38.6463 175.1491 27 R 5.4895 8.8786 123.5495 53.7830 32.2324 175.1711 28 N 4.4415 8.7289 116.9921 54.8622 37.0423 174.3880 29 V 4.2245 7.9674 118.0341 62.9701 33.0350 176.2623 30 K 4.7723 9.3595 126.2658 54.2402 36.0323 175.9853 31 K 4.4155 8.7506 122.8417 56.5808 32.7612 176.2931 32 L 4.7790 7.6087 122.8014 52.8084 44.0087 177.0525 33 Q 4.0157 8.7412 119.7766 58.7337 28.6271 177.2391 34 E 3.9181 8.0518 119.6816 55.5950 29.9700 175.3499 35 E 4.1716 8.7384 127.8731 57.9270 30.1005 176.6489 36 G 4.0929 9.5359 114.0970 44.7934 0.0000 172.0365 37 W 5.1465 7.9539 118.0017 54.6094 33.1959 174.4450 38 L 4.8767 8.5565 122.4087 52.6944 45.4866 174.9072 39 E 4.8745 8.2937 120.8903 54.7691 33.0982 175.0069 40 G 4.2347 8.7493 111.5303 46.1162 0.0000 170.9154 41 E 5.2785 8.8638 120.7873 54.2299 32.1017 174.6708 42 L 4.7689 8.8859 128.6959 53.5455 45.4766 175.7657 43 N 3.8891 9.7299 125.2766 54.8463 37.0877 174.4852 44 G 3.9590 8.2713 102.3942 45.7131 0.0000 172.7796 45 R 4.7380 7.8078 119.7443 54.3608 33.4689 174.2538 46 R 5.1847 8.4068 123.5402 54.9556 32.6850 175.3002 47 G 4.2473 8.9515 108.6616 46.1569 0.0000 172.0117 48 M 5.1276 8.8412 118.5296 54.2559 33.9759 174.9898 49 F 4.9007 7.9421 112.5053 55.4385 41.5078 171.8104 50 P 3.7419 0.0000 0.0000 62.0132 32.1169 177.1490 51 D 4.4443 8.5661 120.4813 55.6320 39.6678 177.4360 52 N 4.7514 8.0932 115.4902 53.6567 37.9916 175.2865 53 F 4.7503 8.3401 118.0899 57.8475 39.5458 175.2463 54 V 5.0828 7.5151 118.3144 60.0596 34.8226 174.4593 55 K 4.7006 9.3252 122.9933 54.3149 35.4589 174.9509 56 E 2.9524 8.5613 128.5011 55.9858 30.1562 175.8671 57 I 4.0569 8.0831 128.6588 60.4932 38.1267 176.3378 58 K 4.1142 8.4696 125.3834 56.5031 32.4254 175.9554 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 2 V 7.91 4.17 2.32 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 1.00 0.00 0.00 1.02 0.00 0.00 3 D 8.69 5.42 0.00 2.74 2.60 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 4 Y 9.28 5.12 0.00 2.80 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 5 I 8.65 4.68 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.44 0.96 0.00 0.00 6 V 8.66 4.14 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 1.03 0.00 0.00 0.88 0.00 0.00 7 E 9.39 4.24 0.00 1.71 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.43 0.00 8 Y 7.74 4.85 0.00 2.65 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 9 D 9.14 4.86 0.00 2.69 2.70 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 10 Y 9.15 4.87 0.00 2.55 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 11 D 7.36 4.98 0.00 2.28 2.35 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.28 4.26 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 13 V 9.10 4.16 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 0.70 0.00 0.00 0.95 0.00 0.00 14 H 7.90 5.10 0.00 3.20 3.11 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.84 4.41 0.00 2.68 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 16 D 8.10 4.76 0.00 2.85 2.88 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 17 E 7.90 5.16 0.00 2.25 2.24 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 2.76 2.42 0.00 18 L 9.07 4.69 0.00 1.72 1.70 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.54 4.66 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 1.28 0.00 0.00 20 I 8.96 4.80 1.77 0.00 0.00 0.58 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 0.88 0.80 0.00 0.00 21 R 8.79 5.09 0.00 2.04 1.81 0.00 3.34 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 22 V 8.75 3.64 2.06 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 0.67 0.00 0.00 0.92 0.00 0.00 23 G 8.85 4.03 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 0.00 24 E 8.19 4.20 0.00 2.10 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 2.32 2.28 0.00 25 I 8.17 4.73 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.54 0.94 0.00 0.00 26 I 8.69 4.49 1.89 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.40 1.03 0.00 0.00 27 R 8.88 5.49 0.00 2.00 2.07 0.00 3.22 0.00 0.00 3.21 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.41 0.00 28 N 8.73 4.44 0.00 2.88 2.90 0.00 0.00 6.99 7.71 0.00 0.00 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 V 7.97 4.22 2.33 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 0.39 0.00 0.00 1.07 0.00 0.00 30 K 9.36 4.77 0.00 1.63 1.61 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.55 7.81 31 K 8.75 4.42 0.00 1.64 1.74 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 32 L 7.61 4.78 0.00 1.54 1.51 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.74 4.02 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 34 E 8.05 3.92 0.00 1.93 1.81 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 1.91 2.38 0.00 35 E 8.74 4.17 0.00 2.00 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 0.00 2.33 2.29 0.00 36 G 9.54 4.09 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 0.00 37 W 7.95 5.15 0.00 3.13 2.93 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 38 L 8.56 4.88 0.00 0.59 0.95 0.62 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.29 4.87 0.00 1.90 1.66 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 2.18 2.19 0.00 40 G 8.75 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 41 E 8.86 5.28 0.00 2.17 1.86 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 2.33 2.25 0.00 42 L 8.89 4.77 0.00 1.70 1.45 0.91 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 43 N 9.73 3.89 0.00 2.83 2.81 0.00 0.00 7.20 7.98 0.00 0.00 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 G 8.27 3.96 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 0.00 0.00 0.00 45 R 7.81 4.74 0.00 1.90 1.87 0.00 3.09 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 46 R 8.41 5.18 0.00 1.74 1.84 0.00 3.32 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 47 G 8.95 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 0.00 0.00 0.00 0.00 48 M 8.84 5.13 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.68 0.00 49 F 7.94 4.90 0.00 2.75 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 50 P 0.00 3.74 0.00 1.95 0.74 0.00 2.46 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 51 D 8.57 4.44 0.00 2.94 2.88 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 52 N 8.09 4.75 0.00 2.76 2.94 0.00 0.00 6.02 7.43 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 53 F 8.34 4.75 0.00 3.04 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 54 V 7.52 5.08 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 0.98 0.00 0.00 0.84 0.00 0.00 55 K 9.33 4.70 0.00 1.91 1.63 0.00 1.74 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.34 7.81 56 E 8.56 2.95 0.00 1.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.74 0.00 57 I 8.08 4.06 1.92 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.59 0.87 0.00 0.00 58 K 8.47 4.11 0.00 1.66 1.63 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.29 7.81