NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2804 8.2644 123.5821 50.8186 21.0580 176.5958 2 V 4.3391 7.1904 114.0339 59.6644 35.2734 173.6989 3 Q 4.2600 8.5465 122.0816 55.4920 30.1069 176.1089 4 Q 4.1850 8.6251 123.0747 57.8672 29.6585 175.0823 5 N 4.7175 7.6262 111.8487 51.4164 39.5189 174.2329 6 K 3.8385 8.7398 119.7357 56.1589 32.4548 175.1418 7 P 4.2893 0.0000 0.0000 62.7077 31.9837 177.0616 8 T 4.1524 8.3124 119.5829 63.2927 70.5642 175.4048 9 R 4.0575 8.3966 120.3802 59.1860 30.0533 179.1591 10 S 4.2534 8.0957 113.2664 60.4719 62.6006 176.2860 11 K 4.0675 7.6397 121.4607 58.7742 32.9464 178.4570 12 R 4.1680 7.8463 116.1733 59.2383 29.2752 179.1942 13 G 3.5325 8.1000 106.5540 47.6381 0.0000 175.2102 14 M 4.1652 7.4159 118.3812 57.2356 32.2167 177.3232 15 R 4.4125 7.5232 116.1108 58.1266 31.1824 177.5008 16 R 4.5428 7.7806 117.1065 55.9982 29.8672 178.2850 17 S 4.4067 7.7308 109.7990 59.2213 62.5468 174.9378 18 H 4.8770 8.1906 117.9783 55.0808 29.4885 172.6465 19 D 4.3397 8.2383 120.9765 53.6500 40.5719 174.6998 20 A 3.7728 8.0815 127.8389 51.1615 18.6822 176.2416 21 L 4.9112 8.1281 119.1801 53.6802 46.8059 177.2077 22 T 4.3980 8.0315 116.6279 62.4545 68.7147 176.1095 23 A 3.6071 8.6900 124.3372 54.2804 15.0875 178.8007 24 V 3.6137 7.8084 118.2799 63.8458 32.3757 175.0982 25 T 3.4184 7.4956 112.5717 63.8308 66.0353 171.0490 26 S 4.5300 7.5524 116.5897 56.8300 65.3688 173.6099 27 L 3.9284 8.4402 120.4668 56.4627 41.4349 177.8363 28 S 5.0926 8.7340 118.6527 59.2904 63.9699 174.6968 29 V 4.5199 7.4687 117.1342 61.1508 34.1599 174.5962 30 D 4.7812 8.1947 119.8351 52.3073 40.8834 174.8451 31 K 4.7203 7.3680 121.4484 56.6420 34.3145 174.1182 32 T 4.5632 6.9723 109.2981 60.5540 70.1513 174.8823 33 S 4.4843 8.6908 121.7491 59.1963 62.9002 175.1480 34 G 4.0906 7.7301 109.1110 45.9040 0.0000 176.4860 35 E 4.1573 7.7428 117.6059 56.3090 29.5903 171.9933 36 K 3.9152 8.7892 127.9695 57.0841 33.8769 176.8041 37 H 4.7700 8.0845 122.3279 55.8481 29.9609 176.1567 38 L 4.9285 8.4685 122.8354 55.1835 41.7317 176.4107 39 R 4.6474 7.7478 120.8248 56.8817 37.3764 174.2469 40 H 4.9438 7.8266 116.7968 54.5345 33.3340 173.4646 41 H 4.8210 7.4322 122.1772 55.8871 32.0752 174.8010 42 I 3.9900 7.3126 117.9644 60.7319 37.5368 175.7866 43 T 3.8454 8.2420 118.0450 62.2240 69.2999 174.1861 44 A 3.8284 8.8223 125.1530 52.5578 16.0076 176.6843 45 D 5.0121 6.4230 118.2510 55.3122 44.4629 175.6653 46 G 3.8097 7.0653 107.4328 43.7897 0.0000 171.6324 47 Y 4.4273 6.5367 115.2000 56.7554 38.7453 172.2126 48 Y 4.1136 8.0031 121.5530 59.1934 39.5457 176.5753 49 R 3.8646 7.8896 121.2964 58.2282 31.3231 177.5173 50 G 3.6180 7.9454 103.7441 44.2385 0.0000 172.7919 51 R 3.2959 5.9991 120.9243 54.8842 28.9727 175.5726 52 K 4.3219 8.4735 128.3450 55.2234 31.9726 176.1752 53 V 3.7832 8.8376 131.3116 62.6218 31.5203 172.9922 54 I 4.7853 7.0896 118.1416 59.6059 42.6124 173.6624 55 A 4.9415 8.3878 124.5976 52.1636 18.4205 176.1505 56 K 4.1605 9.3762 122.7952 57.8836 32.2596 175.5325 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 7.19 4.34 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 0.85 0.00 0.00 0.93 0.00 0.00 3 Q 8.55 4.26 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 4 Q 8.63 4.19 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 5 N 7.63 4.72 0.00 2.80 2.72 0.00 0.00 6.06 7.13 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 6 K 8.74 3.84 0.00 1.76 1.83 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.45 7.81 7 P 0.00 4.29 0.00 2.17 2.07 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 8 T 8.31 4.15 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 9 R 8.40 4.06 0.00 1.85 1.97 0.00 3.13 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 10 S 8.10 4.25 0.00 4.04 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 11 K 7.64 4.07 0.00 1.93 1.89 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.43 7.81 12 R 7.85 4.17 0.00 2.08 2.19 0.00 2.77 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 13 G 8.10 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.42 4.17 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.59 0.00 15 R 7.52 4.41 0.00 2.06 1.97 0.00 3.38 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 16 R 7.78 4.54 0.00 1.95 1.92 0.00 3.30 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 17 S 7.73 4.41 0.00 3.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 H 8.19 4.88 0.00 3.09 3.23 0.00 5.65 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.24 4.34 0.00 2.78 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 20 A 8.08 3.77 1.35 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 0.00 0.00 21 L 8.13 4.91 0.00 1.56 1.52 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.03 4.40 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 1.22 0.00 0.00 23 A 8.69 3.61 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 0.00 0.00 0.00 0.00 0.00 24 V 7.81 3.61 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 0.80 0.00 0.00 0.94 0.00 0.00 25 T 7.50 3.42 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 26 S 7.55 4.53 0.00 3.92 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.44 3.93 0.00 1.69 1.68 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.73 5.09 0.00 3.83 4.34 0.00 0.00 0.00 0.00 0.00 0.00 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 7.47 4.52 1.98 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 0.95 0.00 0.00 0.87 0.00 0.00 30 D 8.19 4.78 0.00 2.79 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 31 K 7.37 4.72 0.00 1.72 1.90 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.18 1.24 7.81 32 T 6.97 4.56 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 0.78 0.00 0.00 33 S 8.69 4.48 0.00 3.99 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 34 G 7.73 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 35 E 7.74 4.16 0.00 2.06 1.94 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 2.33 2.27 0.00 36 K 8.79 3.92 0.00 2.01 1.82 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.47 0.00 0.00 0.00 0.00 1.54 1.66 7.81 37 H 8.08 4.77 0.00 3.29 3.24 0.00 5.66 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.47 4.93 0.00 1.66 1.69 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.75 4.65 0.00 1.68 1.89 0.00 3.17 0.00 0.00 3.06 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 40 H 7.83 4.94 0.00 3.25 3.10 0.00 5.72 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 7.43 4.82 0.00 2.75 2.67 0.00 6.00 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.31 3.99 1.65 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.97 0.58 0.00 0.00 43 T 8.24 3.85 4.22 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 1.11 0.00 0.00 44 A 8.82 3.83 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 6.42 5.01 0.00 2.69 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 46 G 7.07 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 0.00 0.00 0.00 47 Y 6.54 4.43 0.00 3.18 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 48 Y 8.00 4.11 0.00 3.22 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 49 R 7.89 3.86 0.00 1.88 1.95 0.00 3.35 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.97 0.00 50 G 7.95 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.00 3.30 0.00 1.59 1.75 0.00 3.20 0.00 0.00 3.10 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 52 K 8.47 4.32 0.00 1.83 2.16 0.00 2.13 0.00 0.00 1.87 0.00 0.00 3.16 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.59 7.81 53 V 8.84 3.78 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 0.77 0.00 0.00 0.95 0.00 0.00 54 I 7.09 4.79 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.65 1.00 0.00 0.00 55 A 8.39 4.94 1.04 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 56 K 9.38 4.16 0.00 1.76 1.72 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.45 7.81