NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2821 8.2644 123.5822 52.1460 19.8224 175.4922 2 V 4.3010 7.8682 120.4131 59.0900 33.7222 172.4905 3 Q 4.2802 8.5563 120.1756 55.2039 29.8776 176.2728 4 Q 4.1029 8.6728 124.2877 57.8057 29.5852 175.2968 5 N 4.9807 7.3052 112.4631 51.0326 42.4411 174.0082 6 K 4.3410 8.4439 121.9832 54.5126 32.1958 175.0313 7 P 4.2091 0.0000 0.0000 63.0512 31.8565 177.0294 8 T 4.0010 8.4632 117.4710 61.9086 69.1138 174.8698 9 R 3.9612 8.5926 123.4935 59.6921 29.5718 178.5246 10 S 4.1230 8.0662 113.4632 61.0025 62.5552 175.4363 11 K 3.7695 8.0523 121.4915 59.7179 31.6554 178.1511 12 R 3.9837 7.7354 117.5825 59.7023 30.1413 178.1720 13 G 3.7311 7.9851 104.7579 48.2008 0.0000 175.1965 14 M 3.9588 8.1850 120.9972 58.4483 31.6617 178.8132 15 R 3.9871 7.6950 117.2601 59.1705 30.4904 177.8772 16 R 4.6034 8.2066 117.4426 55.6625 29.7148 178.5017 17 S 3.9881 7.4628 115.5231 61.8184 62.9697 175.0966 18 H 4.7015 7.8397 114.9239 55.5266 28.5704 175.5718 19 D 4.5051 7.8056 119.7822 55.0068 41.1454 176.5505 20 A 4.1365 7.7575 121.7888 52.2960 18.9307 176.7749 21 L 4.5165 7.9777 119.4133 53.7507 43.8419 175.3734 22 T 4.7410 7.9966 112.3267 60.6652 71.5029 174.8021 23 A 4.8383 7.9396 132.0732 51.9810 17.2675 179.3430 24 V 4.4075 8.2433 109.9277 62.8848 34.6912 174.8126 25 T 3.5093 8.9366 108.2785 62.1229 67.5889 168.6886 26 S 4.0383 7.4872 120.4018 58.5194 64.8914 170.8820 27 L 4.6624 8.0837 130.7250 55.6382 39.7233 175.9845 28 S 4.8636 8.8424 111.4621 56.7334 66.3846 173.1794 29 V 5.6692 8.1742 122.6556 58.9797 33.6638 174.9084 30 D 4.5486 8.6149 122.8513 54.1843 41.8163 175.8846 31 K 4.2461 8.5059 120.0560 58.7566 32.9552 178.6338 32 T 4.1787 7.9727 114.1552 65.0410 69.1457 174.0949 33 S 4.6750 7.2777 114.0732 57.1647 65.0435 176.2416 34 G 3.7259 8.5545 108.3753 46.1581 0.0000 172.7035 35 E 3.7230 8.3459 121.0336 56.6698 30.4124 176.7451 36 K 4.9193 8.6562 128.1413 55.5059 30.7140 175.2619 37 H 5.0416 9.0456 120.8512 52.7734 31.7928 174.1922 38 L 4.3866 8.2168 120.8598 54.5420 43.3142 176.3921 39 R 4.0177 8.5352 124.2287 58.4577 30.4004 176.3135 40 H 4.5797 10.0579 117.5075 56.3480 26.0114 174.1242 41 H 3.5635 8.2783 109.8214 55.7534 31.1148 174.8574 42 I 3.2422 6.9346 121.1802 60.1501 36.0207 175.0672 43 T 4.3871 9.3560 116.1662 60.3385 70.2405 175.1273 44 A 4.2357 8.1329 123.8422 54.1458 18.6650 177.7648 45 D 4.7305 7.7923 115.6561 51.9895 39.6069 176.7397 46 G 4.3902 8.1782 106.5553 47.5750 0.0000 172.7531 47 Y 4.7262 7.7405 117.3668 58.0175 40.4504 175.8815 48 Y 4.9641 7.7230 127.0250 58.2418 45.4780 177.4249 49 R 3.7519 7.9755 113.1261 55.6650 28.7950 178.0840 50 G 4.1792 8.8249 114.0145 46.2055 0.0000 169.7367 51 R 3.1762 8.4943 116.2060 58.6342 30.7816 175.6198 52 K 3.7541 7.8873 114.7133 56.5290 34.2036 175.4674 53 V 4.0853 8.1804 120.8532 59.9772 33.6817 172.7380 54 I 3.0165 8.3577 126.9854 60.7191 35.7190 174.0204 55 A 3.9971 8.6372 127.8107 52.0667 18.8985 177.1446 56 K 4.2361 8.5201 117.2249 57.4993 34.2329 174.6652 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 A 8.26 4.28 1.27 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 0.00 0.00 0.00 2 V 7.87 4.30 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 0.86 0.00 0.00 0.93 0.00 0.00 3 Q 8.56 4.28 0.00 2.49 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.29 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 4 Q 8.67 4.10 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 5 N 7.31 4.98 0.00 2.69 2.64 0.00 0.00 6.93 7.49 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 6 K 8.44 4.34 0.00 1.71 1.74 0.00 1.62 0.00 0.00 2.36 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 7 P 0.00 4.21 0.00 2.08 2.01 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 8 T 8.46 4.00 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 1.23 0.00 0.00 9 R 8.59 3.96 0.00 2.00 2.07 0.00 3.09 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 10 S 8.07 4.12 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 11 K 8.05 3.77 0.00 1.90 1.96 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.59 7.81 12 R 7.74 3.98 0.00 1.86 2.15 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 13 G 7.99 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.18 3.96 0.00 2.06 2.30 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.62 0.00 15 R 7.69 3.99 0.00 1.84 2.12 0.00 3.26 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 16 R 8.21 4.60 0.00 2.02 1.91 0.00 3.19 0.00 0.00 3.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.48 0.00 17 S 7.46 3.99 0.00 3.78 3.98 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 0.00 0.00 0.00 0.00 18 H 7.84 4.70 0.00 3.18 3.36 0.00 5.69 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.81 4.51 0.00 2.84 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 20 A 7.76 4.14 1.24 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 21 L 7.98 4.52 0.00 1.64 1.65 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.00 4.74 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 23 A 7.94 4.84 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 24 V 8.24 4.41 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 0.84 0.00 0.00 0.94 0.00 0.00 25 T 8.94 3.51 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 26 S 7.49 4.04 0.00 4.16 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 27 L 8.08 4.66 0.00 1.92 1.48 0.93 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.84 4.86 0.00 3.94 3.66 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 0.00 0.00 0.00 29 V 8.17 5.67 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 0.91 0.00 0.00 0.98 0.00 0.00 30 D 8.61 4.55 0.00 2.59 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 31 K 8.51 4.25 0.00 1.75 1.83 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.49 7.81 32 T 7.97 4.18 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 1.38 0.00 0.00 33 S 7.28 4.67 0.00 3.66 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.55 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.35 3.72 0.00 1.76 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 2.12 2.38 0.00 36 K 8.66 4.92 0.00 1.78 1.75 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.45 7.81 37 H 9.05 5.04 0.00 3.27 3.40 0.00 5.32 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.22 4.39 0.00 1.72 1.66 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.54 4.02 0.00 1.86 1.96 0.00 3.57 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 40 H 10.06 4.58 0.00 3.23 3.45 0.00 5.98 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.28 3.56 0.00 3.00 2.99 0.00 5.58 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 42 I 6.93 3.24 1.78 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 1.32 0.69 0.91 0.00 0.00 43 T 9.36 4.39 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 1.25 0.00 0.00 44 A 8.13 4.24 1.38 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 0.00 0.00 45 D 7.79 4.73 0.00 2.90 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 46 G 8.18 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 4.73 0.00 3.11 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 48 Y 7.72 4.96 0.00 2.97 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 0.00 0.00 0.00 49 R 7.98 3.75 0.00 1.38 1.57 0.00 3.03 0.00 0.00 2.84 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.50 0.00 50 G 8.82 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.49 3.18 0.00 1.97 2.00 0.00 3.23 0.00 0.00 3.14 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 52 K 7.89 3.75 0.00 0.79 1.27 0.00 1.29 0.00 0.00 1.42 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.64 0.21 7.81 53 V 8.18 4.09 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 0.74 0.00 0.00 1.04 0.00 0.00 54 I 8.36 3.02 1.85 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 1.33 0.34 0.90 0.00 0.00 55 A 8.64 4.00 1.23 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 56 K 8.52 4.24 0.00 1.93 1.86 0.00 1.50 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.47 7.81