NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.4065 8.1744 117.3764 63.5836 70.0807 174.6544 2 Q 4.1788 8.8681 130.6214 55.1799 27.5346 174.9560 3 S 4.1182 8.1846 118.9017 61.4744 64.6251 174.2270 4 H 4.8759 7.7432 117.8214 55.3978 31.8611 172.8015 5 Y 3.5822 7.8110 122.2749 59.2639 35.6871 170.6927 6 G 3.9972 7.7730 107.5668 44.3259 0.0000 173.8060 7 Q 4.1695 8.6894 128.0008 56.9137 29.0437 176.9581 8 C 4.9189 9.1252 122.4661 55.7420 43.4584 174.3215 9 G 4.5645 7.3656 112.1128 45.5440 0.0000 172.9409 10 G 4.1308 7.9829 113.3949 45.1420 0.0000 170.0704 11 I 3.7383 6.8485 121.1767 63.4512 37.2952 176.5238 12 G 4.0380 9.0861 113.6172 45.5924 0.0000 172.6237 13 Y 4.6294 7.7223 120.4063 56.4534 40.7447 174.3596 14 S 4.5015 7.3360 114.5968 58.1469 63.7558 175.4972 15 G 4.1128 7.9620 107.4171 42.8808 0.0000 171.9985 16 P 4.5406 0.0000 0.0000 62.3773 31.2513 178.1079 17 T 4.3975 7.5014 108.7345 62.1120 68.1520 175.8091 18 V 3.8909 7.4102 127.4064 63.3296 31.3182 175.1454 19 C 4.9616 8.0397 118.7768 54.4963 45.7721 171.5517 20 A 4.7690 7.9558 124.4722 49.9892 20.8619 176.6687 21 S 4.4317 8.1927 114.5388 58.4060 63.7657 173.3946 22 G 4.2363 8.8662 114.0172 46.0024 0.0000 174.5164 23 T 4.4859 7.3955 108.5175 60.6477 70.8973 174.7838 24 T 4.6063 7.9066 113.3828 60.9861 68.6385 175.2657 25 C 5.6292 8.0404 108.6514 56.8479 40.3595 172.2043 26 Q 4.8510 8.0196 119.1897 52.4342 31.8878 176.1697 27 V 4.1040 8.3284 112.6993 61.9022 33.5156 173.1927 28 L 4.8945 8.5312 123.2149 55.4427 39.9242 179.9087 29 N 4.5755 9.2011 113.1673 51.7556 37.7378 174.0007 30 P 4.1207 0.0000 0.0000 65.5856 31.6168 178.2745 31 Y 3.9992 7.9013 115.2008 60.3181 38.3324 174.8696 32 A 4.5792 8.3040 122.4560 50.7016 21.7974 175.6183 33 S 4.5953 8.9679 118.5005 59.2195 63.4270 172.9752 34 Q 4.6378 9.2232 128.2340 54.1057 33.0450 173.4287 35 C 4.5904 8.9544 122.7729 56.9915 39.2587 174.2921 36 L 4.0206 7.7891 122.4567 54.7789 41.4001 177.1738 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 8.17 4.41 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 1.25 0.00 0.00 2 Q 8.87 4.18 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 7.07 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 3 S 8.18 4.12 0.00 3.88 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 4 H 7.74 4.88 0.00 2.84 2.87 0.00 5.89 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 Y 7.81 3.58 0.00 3.15 2.91 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 6 G 7.77 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 0.00 0.00 0.00 7 Q 8.69 4.17 0.00 1.88 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.34 7.04 0.00 0.00 0.00 0.00 0.00 1.51 2.17 0.00 8 C 9.13 4.92 0.00 2.90 3.09 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 9 G 7.37 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.85 3.74 1.41 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 1.11 0.33 0.95 0.00 0.00 12 G 9.09 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 0.00 0.00 0.00 13 Y 7.72 4.63 0.00 2.93 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 14 S 7.34 4.50 0.00 3.84 3.52 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 0.00 15 G 7.96 4.11 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 0.00 0.00 0.00 16 P 0.00 4.54 0.00 2.17 2.03 0.00 2.42 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.66 0.00 17 T 7.50 4.40 4.33 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 1.49 0.00 0.00 18 V 7.41 3.89 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 1.08 0.00 0.00 1.02 0.00 0.00 19 C 8.04 4.96 0.00 2.99 2.99 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 20 A 7.96 4.77 1.22 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 0.00 0.00 21 S 8.19 4.43 0.00 3.84 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 22 G 8.87 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 0.00 0.00 0.00 23 T 7.40 4.49 4.36 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 24 T 7.91 4.61 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 1.24 0.00 0.00 25 C 8.04 5.63 0.00 2.94 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 26 Q 8.02 4.85 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.98 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 27 V 8.33 4.10 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 0.83 0.00 0.00 0.93 0.00 0.00 28 L 8.53 4.89 0.00 1.71 0.92 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 29 N 9.20 4.58 0.00 3.07 3.07 0.00 0.00 6.01 7.86 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 30 P 0.00 4.12 0.00 1.85 2.01 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 31 Y 7.90 4.00 0.00 3.02 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 32 A 8.30 4.58 1.20 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 0.00 0.00 33 S 8.97 4.60 0.00 3.92 3.75 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 34 Q 9.22 4.64 0.00 2.02 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.50 0.00 35 C 8.95 4.59 0.00 2.93 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 36 L 7.79 4.02 0.00 1.71 1.57 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00