NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2510 8.4293 120.2071 56.4511 31.5735 176.6498 20 I 3.9309 7.4797 112.7790 58.1119 35.6926 174.4581 21 D 4.4926 7.4481 133.6823 54.5386 43.5893 177.9915 22 Y 4.8163 7.7233 112.8216 57.5512 43.3527 176.0008 23 K 4.0825 7.2486 120.2924 59.5916 33.0814 178.0367 24 D 4.7397 9.1801 121.1462 53.4390 40.2128 177.5632 25 I 3.5641 8.5071 121.1288 63.6011 38.3330 177.4137 26 A 3.8741 8.1470 122.0779 55.3526 18.4284 178.5518 27 T 4.6765 8.0119 111.7649 63.9103 69.0996 175.9107 28 L 4.8105 7.8168 120.2572 56.3356 45.0533 179.3201 29 K 4.0684 7.6052 116.3003 58.4695 32.2192 177.5987 30 N 4.4680 8.1006 115.6908 55.0381 38.3129 174.9462 31 Y 4.6948 8.2731 117.7099 57.2570 39.2004 173.9420 32 I 4.8043 6.7616 117.6888 59.7909 39.6647 173.0957 33 T 3.9204 8.0474 112.0261 61.9997 70.2487 172.6755 34 E 4.0349 9.0008 121.1620 58.3489 29.1551 177.8378 35 S 4.5459 7.9766 112.5208 57.0121 63.7548 174.8242 36 G 4.0200 8.7548 108.6242 46.3328 0.0000 173.9229 37 K 4.1627 7.5453 119.1629 55.4290 32.6588 176.3605 38 I 4.0456 8.3843 124.1361 61.7624 37.4481 176.3798 39 V 3.8235 8.2712 121.2373 60.7605 32.0260 174.7232 40 P 4.5064 0.0000 0.0000 63.0790 31.7981 176.0701 41 S 4.7210 8.5422 112.6239 58.4412 63.1103 176.0870 42 R 4.3012 8.1551 118.7590 59.7601 29.8197 178.3191 43 I 4.4243 7.5063 108.6675 61.2156 38.3932 176.4098 44 T 4.5736 7.8336 116.0713 65.1486 73.8633 174.9931 45 G 4.0252 9.0768 108.7358 46.6082 0.0000 174.1531 46 T 4.1340 7.2213 108.9106 62.7523 65.6464 174.2615 47 R 3.2917 8.6612 115.4464 56.2709 28.2301 176.0072 48 A 3.8470 7.3013 121.5118 52.7410 17.7701 179.9675 49 K 3.8117 7.7551 113.8294 59.8867 32.2811 178.6703 50 Y 4.1975 7.8829 116.1212 60.5764 37.7689 177.2101 51 Q 3.9770 8.2903 120.8991 59.3317 29.1111 178.7898 52 R 3.9779 8.0108 118.2861 59.5730 30.1096 178.9508 53 Q 3.9904 7.6322 117.3368 58.8159 28.5125 178.3820 54 L 3.8033 8.4754 121.5040 58.1705 41.9725 179.0228 55 A 4.0829 7.9983 120.6268 55.0074 18.2517 179.3831 56 R 3.8621 7.9042 116.6053 59.5228 30.0366 178.6720 57 A 4.1180 7.8483 120.0979 55.4614 18.3030 179.6275 58 I 3.8784 7.1577 115.3245 64.9304 37.3568 178.1159 59 K 4.1788 8.0869 119.8877 58.7667 31.9869 179.1991 60 R 4.0821 8.3182 116.1843 59.7477 29.4651 178.8547 61 A 4.0951 8.7422 121.3764 54.8123 18.0935 179.7411 62 R 3.9914 7.6038 117.2811 58.6000 30.2353 178.4142 63 Y 4.2641 7.9029 116.5861 60.7370 37.8222 177.3968 64 L 4.2464 7.5903 116.9911 54.1669 41.3269 177.3003 65 S 3.7004 7.7112 110.4524 58.9492 61.7974 173.0650 66 L 4.1664 7.8658 119.2262 57.2719 41.5044 177.2580 67 L 4.8584 7.4626 116.3188 51.9360 45.3825 173.7868 68 P 4.5267 0.0000 0.0000 62.3592 32.2404 175.2794 69 Y 4.2332 8.0864 117.1557 59.8706 39.6671 177.5046 70 T 4.6725 7.0192 113.4982 61.3616 65.0888 174.8997 71 D 4.5776 8.4300 119.3141 54.9776 46.3446 177.1842 72 R 4.0640 7.8191 116.3637 58.2975 30.3722 176.0147 73 H 4.3748 7.6282 122.3430 56.2426 30.1778 172.4934 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 8.43 4.25 0.00 1.80 1.95 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 2.09 2.18 0.00 20 I 7.48 3.93 1.85 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 1.38 0.58 0.87 0.00 0.00 21 D 7.45 4.49 0.00 2.33 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 0.00 0.00 0.00 0.00 22 Y 7.72 4.82 0.00 3.06 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.25 4.08 0.00 1.84 1.86 0.00 1.38 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.11 1.31 7.81 24 D 9.18 4.74 0.00 2.72 2.62 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 25 I 8.51 3.56 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 1.25 1.20 1.00 0.00 0.00 26 A 8.15 3.87 1.34 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 0.00 0.00 27 T 8.01 4.68 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 28 L 7.82 4.81 0.00 1.93 1.68 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.61 4.07 0.00 1.63 1.89 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.60 7.81 30 N 8.10 4.47 0.00 2.33 2.77 0.00 0.00 6.06 7.55 0.00 0.00 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 8.27 4.69 0.00 3.08 3.02 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 32 I 6.76 4.80 1.89 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 1.45 1.65 1.01 0.00 0.00 33 T 8.05 3.92 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 1.26 0.00 0.00 34 E 9.00 4.03 0.00 2.00 2.01 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 2.32 2.26 0.00 35 S 7.98 4.55 0.00 3.98 4.06 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 0.00 0.00 0.00 0.00 36 G 8.75 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 0.00 0.00 0.00 37 K 7.55 4.16 0.00 1.87 1.76 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.59 7.81 38 I 8.38 4.05 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.49 0.95 0.00 0.00 39 V 8.27 3.82 2.14 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 0.70 0.00 0.00 1.15 0.00 0.00 40 P 0.00 4.51 0.00 1.96 2.04 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 41 S 8.54 4.72 0.00 3.92 3.85 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 0.00 0.00 0.00 42 R 8.16 4.30 0.00 1.85 1.99 0.00 3.26 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 43 I 7.51 4.42 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.45 0.92 0.00 0.00 44 T 7.83 4.57 4.32 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 1.42 0.00 0.00 45 G 9.08 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 46 T 7.22 4.13 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 1.30 0.00 0.00 47 R 8.66 3.29 0.00 1.06 1.46 0.00 3.34 0.00 0.00 3.09 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 0.00 48 A 7.30 3.85 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 49 K 7.76 3.81 0.00 1.83 1.83 0.00 1.77 0.00 0.00 1.91 0.00 0.00 3.10 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.75 1.66 7.81 50 Y 7.88 4.20 0.00 3.19 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.29 3.98 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 52 R 8.01 3.98 0.00 1.92 1.99 0.00 3.21 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.03 0.00 53 Q 7.63 3.99 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 54 L 8.48 3.80 0.00 1.77 1.71 0.04 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.00 4.08 1.34 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 0.00 0.00 56 R 7.90 3.86 0.00 2.10 1.97 0.00 3.11 0.00 0.00 3.18 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 57 A 7.85 4.12 1.42 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 0.00 0.00 58 I 7.16 3.88 2.01 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 1.54 0.72 0.89 0.00 0.00 59 K 8.09 4.18 0.00 2.06 1.96 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.50 7.81 60 R 8.32 4.08 0.00 1.79 2.15 0.00 2.96 0.00 0.00 2.73 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 61 A 8.74 4.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.60 3.99 0.00 1.08 0.66 0.00 2.21 0.00 0.00 2.78 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 63 Y 7.90 4.26 0.00 3.13 3.06 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 0.00 0.00 0.00 0.00 64 L 7.59 4.25 0.00 2.04 1.71 0.86 0.64 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 65 S 7.71 3.70 0.00 4.02 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 66 L 7.87 4.17 0.00 1.86 1.76 1.21 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.46 4.86 0.00 1.60 1.42 0.93 1.00 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 68 P 0.00 4.53 0.00 2.18 2.03 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 69 Y 8.09 4.23 0.00 2.94 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 7.02 4.67 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 1.26 0.00 0.00 71 D 8.43 4.58 0.00 2.70 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 7.82 4.06 0.00 1.90 2.00 0.00 3.17 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 73 H 7.63 4.37 0.00 3.20 3.07 0.00 5.78 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