NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.2191 8.3149 121.7854 56.2057 33.6024 174.7778 7 E 4.5162 8.3687 124.9400 54.6617 31.9205 173.4449 8 L 5.3466 9.0849 122.3553 53.2111 46.7482 175.5392 9 V 4.9553 8.6169 113.6081 59.6518 36.4829 174.0424 10 L 4.9956 8.6551 125.2968 53.2626 44.3559 175.1596 11 A 4.5657 8.6740 128.7012 51.6839 18.8134 178.1921 12 L 3.6737 8.8972 124.1434 57.4125 42.2239 176.6780 13 Y 5.0020 7.2772 113.7493 56.4968 42.2520 174.4529 14 D 4.9807 8.8538 120.4127 54.9647 42.1424 175.6993 15 Y 4.8833 9.2916 122.2805 56.3921 42.5910 173.2299 16 Q 4.6698 7.9200 128.2322 53.8803 30.4027 174.7854 17 E 4.2112 8.4898 125.4015 57.1814 29.6336 177.3905 18 K 4.3451 9.2037 121.8457 56.5487 33.1809 176.1538 19 S 4.5805 7.3967 111.9628 56.6962 65.0410 174.2974 20 P 4.2597 0.0000 0.0000 65.2010 31.2638 177.7624 21 R 4.2477 7.9736 113.2117 56.9758 30.0764 175.5730 22 E 5.3881 8.1067 118.6395 55.2343 31.9239 175.2988 23 V 4.6941 8.2430 113.2565 60.1387 35.5318 175.5652 24 T 5.0180 8.5317 118.8887 62.7777 70.1754 174.1328 25 M 4.9840 9.1748 121.3313 53.8191 35.3598 173.5430 26 K 5.0597 9.4374 121.7919 54.1513 35.0772 175.5537 27 K 4.0489 10.1378 128.0064 58.5065 32.4292 177.2491 28 G 4.1999 9.1024 114.3708 45.1912 0.0000 173.4159 29 D 4.5721 8.2352 120.4111 54.3768 42.2563 175.6258 30 I 4.6813 8.3474 122.9927 60.0111 38.5714 174.9196 31 L 4.8141 8.9165 127.8140 52.9887 45.0416 176.1966 32 T 4.5358 8.1006 119.0452 63.2274 69.6323 173.7354 33 L 4.4285 8.7616 130.4089 54.8311 41.8204 176.1569 34 L 4.3481 8.7882 127.7314 56.7724 43.0371 177.4169 35 N 4.7876 7.7182 117.2651 52.1515 42.0306 174.9428 36 S 4.0319 8.2874 119.9709 57.7904 63.6285 176.0303 37 T 3.9430 8.5262 113.9819 64.5837 68.7498 174.2040 38 N 4.8678 7.5170 117.4857 52.3377 39.8392 175.0364 39 K 4.3826 8.7259 123.0677 58.9046 33.6361 177.2421 40 D 4.4291 8.6689 119.3319 54.6112 42.9828 176.5683 41 W 5.0874 8.4517 117.2017 54.5897 31.8066 175.2408 42 W 5.4420 9.3729 125.0086 54.9598 31.7804 174.7759 43 K 4.4281 9.0960 125.4830 55.4017 33.2467 175.8758 44 V 5.0393 8.7538 119.6719 59.6151 36.8556 173.7762 45 E 5.0308 8.9538 122.1732 54.5465 32.2374 174.5958 46 V 4.2361 9.3009 127.6025 62.1991 34.3364 175.4131 47 N 4.0652 9.5489 123.4717 54.6868 35.5889 173.4701 48 D 4.5581 8.0615 117.4489 55.5463 39.1021 174.0519 49 R 4.7705 8.1450 118.0310 54.5226 33.8611 174.4774 50 Q 5.6273 8.5031 121.0168 52.9512 32.3990 175.0058 51 G 3.9561 7.7409 107.4714 46.8058 0.0000 171.1599 52 F 5.4894 8.4567 118.1722 56.5164 41.2607 176.0603 53 V 4.6169 9.0191 113.4366 58.9624 36.7857 173.3082 54 P 3.4382 0.0000 0.0000 61.9013 31.6769 177.9279 55 A 2.8649 8.3684 126.0033 54.4741 18.3009 179.7854 56 A 3.8383 7.3832 117.7839 55.1243 18.6871 177.7789 57 Y 4.5214 7.8349 111.9348 58.9421 38.4056 175.1670 58 V 5.5405 7.1733 112.2027 58.3822 36.1868 174.7102 59 K 4.6445 8.2010 122.4919 54.3127 35.1871 175.1817 60 K 4.4705 8.9696 128.4776 56.6706 33.1806 176.6531 61 L 4.4394 8.6282 127.7028 52.4140 41.6745 175.6876 62 A 4.0672 8.5679 126.3479 52.0781 19.0634 178.6835 63 A 4.0341 8.7614 124.9936 55.1761 18.6259 178.7001 64 A 4.1364 8.0800 116.4748 53.3484 18.7417 177.0908 65 W 4.5560 7.8183 115.2865 54.4131 32.2275 174.9183 66 S 4.5218 8.6258 116.0653 57.4424 62.5606 173.0030 67 H 4.8110 8.6522 125.2707 53.6196 29.6921 173.5065 68 P 4.5103 0.0000 0.0000 62.0394 31.9549 175.6795 69 Q 4.1577 8.3690 121.1849 55.9932 29.5822 175.6380 70 F 4.5806 8.8508 125.9860 58.5879 39.4727 174.8138 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 6 K 8.31 4.22 0.00 1.72 1.77 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.45 7.81 7 E 8.37 4.52 0.00 1.96 1.75 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 2.28 2.35 0.00 8 L 9.08 5.35 0.00 1.51 1.48 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.62 4.96 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 0.78 0.00 0.00 1.04 0.00 0.00 10 L 8.66 5.00 0.00 1.55 1.25 0.79 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.67 4.57 1.40 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 0.00 0.00 0.00 12 L 8.90 3.67 0.00 0.27 0.62 0.67 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.28 5.00 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.85 4.98 0.00 2.70 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.29 4.88 0.00 3.22 2.90 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 16 Q 7.92 4.67 0.00 1.94 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.64 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 17 E 8.49 4.21 0.00 2.09 2.04 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 2.29 2.31 0.00 18 K 9.20 4.35 0.00 1.89 1.90 0.00 1.92 0.00 0.00 1.83 0.00 0.00 3.30 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.47 7.81 19 S 7.40 4.58 0.00 3.91 3.87 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 20 P 0.00 4.26 0.00 2.06 2.18 0.00 3.66 0.00 0.00 3.70 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 21 R 7.97 4.25 0.00 2.07 2.16 0.00 2.63 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 22 E 8.11 5.39 0.00 2.11 2.21 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 2.34 2.24 0.00 23 V 8.24 4.69 2.16 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 0.75 0.00 0.00 1.12 0.00 0.00 24 T 8.53 5.02 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 1.28 0.00 0.00 25 M 9.17 4.98 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.73 0.00 26 K 9.44 5.06 0.00 1.90 2.00 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.46 7.81 27 K 10.14 4.05 0.00 1.76 1.81 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.67 1.79 7.81 28 G 9.10 4.20 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 0.00 29 D 8.24 4.57 0.00 2.74 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.35 4.68 1.88 0.00 0.00 0.84 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 0.85 0.90 0.00 0.00 31 L 8.92 4.81 0.00 1.60 1.71 1.01 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.10 4.54 4.23 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 1.19 0.00 0.00 33 L 8.76 4.43 0.00 1.54 1.64 0.80 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.79 4.35 0.00 1.58 1.63 0.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 35 N 7.72 4.79 0.00 2.69 2.63 0.00 0.00 6.72 7.63 0.00 0.00 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 S 8.29 4.03 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.53 3.94 4.27 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 1.22 0.00 0.00 38 N 7.52 4.87 0.00 2.95 3.27 0.00 0.00 7.23 6.56 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 39 K 8.73 4.38 0.00 1.98 2.00 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 40 D 8.67 4.43 0.00 2.78 2.35 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 41 W 8.45 5.09 0.00 3.16 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.37 5.44 0.00 3.23 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 43 K 9.10 4.43 0.00 1.31 1.44 0.00 1.14 0.00 0.00 1.43 0.00 0.00 2.64 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.99 0.31 7.81 44 V 8.75 5.04 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 0.75 0.00 0.00 0.98 0.00 0.00 45 E 8.95 5.03 0.00 1.99 1.75 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 2.18 2.32 0.00 46 V 9.30 4.24 2.12 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 1.06 0.00 0.00 0.98 0.00 0.00 47 N 9.55 4.07 0.00 2.96 3.07 0.00 0.00 6.32 8.06 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 48 D 8.06 4.56 0.00 2.87 2.83 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 49 R 8.15 4.77 0.00 1.88 1.78 0.00 3.08 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.76 0.00 50 Q 8.50 5.63 0.00 1.85 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.07 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 51 G 7.74 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.46 5.49 0.00 3.11 3.35 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 53 V 9.02 4.62 1.88 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 0.89 0.00 0.00 0.98 0.00 0.00 54 P 0.00 3.44 0.00 1.32 1.00 0.00 2.37 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.68 0.00 55 A 8.37 2.86 -0.02 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 56 A 7.38 3.84 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 57 Y 7.83 4.52 0.00 3.04 3.04 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 58 V 7.17 5.54 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 0.84 0.00 0.00 1.07 0.00 0.00 59 K 8.20 4.64 0.00 1.59 1.48 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.24 7.81 60 K 8.97 4.47 0.00 1.86 1.70 0.00 1.93 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.60 1.35 7.81 61 L 8.63 4.44 0.00 1.42 1.25 0.82 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.57 4.07 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.76 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 4.14 1.30 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 0.00 0.00 0.00 65 W 7.82 4.56 0.00 3.17 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 66 S 8.63 4.52 0.00 3.82 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 67 H 8.65 4.81 0.00 3.23 3.26 0.00 5.76 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.51 0.00 2.10 2.05 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 69 Q 8.37 4.16 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 70 F 8.85 4.58 0.00 2.91 2.95 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 0.00 0.00 0.00