NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2931 8.0176 111.0760 61.8502 70.6523 173.1718 2 T 3.8523 8.2033 116.4514 60.3898 67.4124 171.8012 3 C 4.5732 9.6873 126.4006 57.5122 40.3883 173.2920 4 C 5.3863 8.5995 121.8081 54.5381 42.2843 173.7042 5 P 3.9117 0.0000 0.0000 64.0595 31.4615 177.1596 6 S 4.7782 7.4073 112.3572 55.6325 67.0889 174.7914 7 I 3.6490 8.1663 123.3247 64.5039 36.8340 178.9922 8 V 3.8503 7.9406 119.8415 65.4529 31.5182 177.8692 9 A 4.1772 8.0538 120.6042 54.9750 18.1788 179.6724 10 R 3.8789 8.3809 117.9753 59.5770 30.1713 178.8904 11 S 4.3411 8.4471 114.5116 61.6394 62.9544 176.2323 12 N 4.3678 8.8177 120.5064 55.8490 38.2534 176.9962 13 F 3.9666 8.8339 122.4121 61.6168 39.2763 177.0641 14 N 4.5119 8.7678 115.0046 56.0925 38.4914 177.4626 15 V 3.6947 8.1640 120.1644 66.1802 31.4793 177.0285 16 C 3.9315 8.3345 117.2633 59.2605 44.6075 174.6644 17 R 4.2688 7.4769 117.8530 56.1000 29.4769 177.4768 18 L 3.9795 7.8291 119.6496 57.5921 41.7143 176.7808 19 P 4.2309 0.0000 0.0000 63.6366 31.6424 175.7733 20 G 3.7446 8.1589 106.8822 46.9373 0.0000 173.9384 21 T 4.4595 6.9857 113.9012 62.5041 73.1994 174.2550 22 P 4.5540 0.0000 0.0000 61.3203 29.1729 176.1252 23 E 3.8876 8.0925 125.1777 60.4847 29.9857 178.6435 24 A 4.0771 7.9551 120.0168 55.0221 18.4993 179.5764 25 L 4.1158 7.6850 118.5349 57.4610 41.7980 179.8373 26 C 3.8050 8.4414 116.6317 59.8397 40.0476 175.9386 27 A 4.3891 8.3306 122.4818 55.6645 18.1558 179.8369 28 T 3.8885 8.0335 107.9653 65.4610 68.7270 176.4021 29 Y 4.3029 8.9081 119.2072 59.6161 37.8397 176.9403 30 T 4.5378 7.7978 107.4395 60.4580 69.4116 174.0228 31 G 4.0138 7.7629 108.0366 47.7351 0.0000 172.9487 32 C 5.4437 8.6037 115.0374 54.7601 43.7165 174.6347 33 I 4.4401 9.0085 114.5464 59.2773 39.4638 174.9627 34 I 4.6442 8.5572 129.3222 60.4129 37.0598 175.1004 35 I 4.4239 8.6282 122.1508 58.1855 39.2824 175.2000 36 P 4.0383 0.0000 0.0000 65.3534 31.2465 177.3713 37 G 3.6979 7.5748 106.8428 45.8208 0.0000 174.0701 38 A 4.1655 8.5313 126.1864 54.0923 18.6158 176.4852 39 T 4.6207 7.3102 107.6896 60.9339 70.8334 171.6968 40 C 4.8654 8.3185 121.3045 54.2488 41.8186 172.4659 41 P 4.4786 0.0000 0.0000 62.6109 31.6177 177.4978 42 G 3.7400 8.8406 110.0987 48.6579 0.0000 174.1597 43 D 4.7011 8.1339 117.0321 53.9880 40.1521 176.4408 44 Y 4.4001 8.4979 117.2765 56.6764 38.9372 175.3777 45 A 4.5584 8.1970 123.9382 50.8043 19.4204 177.4307 46 N 4.5730 8.5160 117.9652 54.2410 39.0595 175.2380 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 8.02 4.29 4.21 0.00 0.00 0.00 0.00 0.00 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 2 T 8.20 3.85 3.56 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 1.24 0.00 0.00 3 C 9.69 4.57 0.00 3.03 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 4 C 8.60 5.39 0.00 2.83 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.91 0.00 1.75 0.83 0.00 3.22 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.75 0.00 6 S 7.41 4.78 0.00 3.98 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 7 I 8.17 3.65 1.86 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 1.50 0.67 0.91 0.00 0.00 8 V 7.94 3.85 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 1.33 0.00 0.00 0.93 0.00 0.00 9 A 8.05 4.18 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.38 3.88 0.00 2.03 2.06 0.00 3.10 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 11 S 8.45 4.34 0.00 4.09 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 12 N 8.82 4.37 0.00 3.04 2.96 0.00 0.00 6.64 8.14 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 13 F 8.83 3.97 0.00 3.22 3.27 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 14 N 8.77 4.51 0.00 2.88 2.93 0.00 0.00 7.05 7.57 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 15 V 8.16 3.69 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 1.07 0.00 0.00 0.97 0.00 0.00 16 C 8.33 3.93 0.00 2.77 2.98 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 17 R 7.48 4.27 0.00 2.02 1.85 0.00 3.35 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.86 0.00 18 L 7.83 3.98 0.00 1.72 1.71 0.91 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.23 0.00 2.13 2.14 0.00 3.81 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 1.91 1.89 0.00 20 G 8.16 3.74 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 0.00 0.00 0.00 21 T 6.99 4.46 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 22 P 0.00 4.55 0.00 2.11 2.11 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 23 E 8.09 3.89 0.00 2.09 2.22 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 2.54 2.58 0.00 24 A 7.96 4.08 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 25 L 7.68 4.12 0.00 1.63 1.38 0.84 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.44 3.80 0.00 1.86 1.41 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.33 4.39 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.03 3.89 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 29 Y 8.91 4.30 0.00 2.78 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 30 T 7.80 4.54 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 1.28 0.00 0.00 31 G 7.76 4.01 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 0.00 0.00 0.00 32 C 8.60 5.44 0.00 3.09 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.01 4.44 1.70 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.66 0.72 0.00 0.00 34 I 8.56 4.64 1.92 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.65 0.94 0.00 0.00 35 I 8.63 4.42 1.82 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 1.15 0.94 0.82 0.00 0.00 36 P 0.00 4.04 0.00 2.05 2.17 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 37 G 7.57 3.70 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 0.00 0.00 0.00 38 A 8.53 4.17 1.28 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 0.00 0.00 0.00 39 T 7.31 4.62 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 40 C 8.32 4.87 0.00 3.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.33 2.04 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 42 G 8.84 3.74 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 0.00 0.00 0.00 43 D 8.13 4.70 0.00 2.88 2.98 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 44 Y 8.50 4.40 0.00 2.84 2.94 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 0.00 0.00 0.00 45 A 8.20 4.56 1.26 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 0.00 0.00 0.00 46 N 8.52 4.57 0.00 2.65 2.67 0.00 0.00 7.01 7.56 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