NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2939 8.4444 121.4693 56.2094 29.6793 174.2571 2 T 4.3542 8.1939 119.6731 59.5976 70.2805 171.6254 3 S 4.8713 9.0496 124.8410 56.8698 67.2538 172.5415 4 Y 4.7390 8.3460 118.9552 56.6710 41.4547 175.1343 5 T 4.8215 8.4281 119.3333 61.8095 72.4822 173.0509 6 L 4.8294 8.2017 124.3556 53.6715 45.3843 175.0631 7 N 5.1375 8.3531 120.0948 51.8540 42.5806 173.4812 8 E 4.6401 8.3283 119.5920 55.1509 32.5709 174.4411 9 V 4.0643 8.2816 125.1022 61.6222 32.4202 175.8161 10 V 4.3367 8.1221 126.4385 59.4294 33.1288 173.7716 11 P 4.5737 0.0000 0.0000 61.4847 30.2288 176.4978 12 L 4.1889 8.6811 127.1431 58.3589 41.5640 178.7273 13 K 4.1398 7.9200 115.2393 58.7589 32.5098 177.8523 14 E 3.9189 7.8182 119.5048 57.6652 29.5889 176.8593 15 F 4.9361 8.0889 115.4810 56.9433 41.3377 175.6173 16 V 4.5650 7.4408 111.9288 58.3705 34.7133 173.2577 17 P 4.5693 0.0000 0.0000 62.2262 31.9602 176.6520 18 E 3.9900 8.7908 118.4798 58.4164 29.4589 177.8923 19 W 4.6652 8.0708 117.6307 54.7932 31.2822 175.0900 20 V 4.6743 8.3389 114.9312 59.6499 35.2144 174.6421 21 R 4.6735 8.3889 119.0678 54.4012 32.7731 175.5905 22 I 4.4115 7.6080 114.2176 59.1769 40.0576 175.0475 23 G 3.7996 7.3385 107.9858 45.9796 0.0000 172.2299 24 F 4.9689 8.3813 117.1182 55.5838 41.5587 175.0327 25 S 4.7753 8.2968 115.8968 56.9155 66.1234 173.0663 26 A 4.5464 8.0815 122.2980 51.1922 21.7116 175.7249 27 T 4.7513 8.1393 110.7311 59.9657 72.0075 172.6122 28 T 4.9776 8.2164 111.1880 60.3670 73.4593 174.7714 29 G 4.2315 8.6315 114.0938 45.4190 0.0000 174.1983 30 A 4.1078 9.3270 125.9551 54.0860 18.6812 178.2374 31 E 4.5025 7.8556 115.4355 54.7627 31.7116 174.0224 32 F 5.1416 6.9039 115.7587 56.1483 40.6473 172.7546 33 A 4.4065 8.0095 120.7829 51.4931 21.2747 175.8771 34 A 4.2628 8.4992 123.0735 51.9495 19.3839 177.2349 35 H 4.7791 8.6428 118.2135 54.0891 31.0447 173.0059 36 E 4.7246 8.5334 122.7422 54.2546 33.2746 175.2771 37 V 4.2462 7.9773 119.1250 61.1740 33.9451 175.2558 38 L 4.5621 8.2396 125.1261 55.4191 43.2166 176.2884 39 S 4.7517 7.5709 110.1306 57.4492 65.2575 173.7094 40 W 5.5629 8.5779 129.8802 56.2674 33.5658 173.3087 41 Y 4.8843 8.9313 124.5690 55.8777 41.4715 174.0305 42 F 4.3024 7.2952 125.8090 56.8607 42.6033 173.2415 43 H 4.4241 6.7947 124.5664 54.8083 32.4621 172.7237 44 S 4.4901 7.9780 120.2522 56.4544 65.9662 173.1980 45 E 4.3705 8.2821 121.3902 55.0310 31.7864 173.8519 46 L 4.5671 8.2683 127.8645 52.8225 44.1579 175.3400 47 A 3.9732 8.8337 129.9363 54.8890 18.5619 179.1435 48 G 4.0486 7.9746 101.5275 45.9576 0.0000 173.2209 49 T 4.4884 7.1413 113.6528 61.4889 75.5387 173.8628 50 S 4.3295 7.0661 118.2281 57.5827 63.5588 174.3565 51 S 4.7872 7.1553 125.7488 58.7767 67.9623 177.1996 52 N 4.5489 7.5399 121.9626 52.7958 37.2991 174.2710 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 E 8.44 4.29 0.00 1.92 1.97 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 2.18 2.35 0.00 2 T 8.19 4.35 4.17 0.00 0.00 0.00 0.00 0.00 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 3 S 9.05 4.87 0.00 3.75 3.68 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 4 Y 8.35 4.74 0.00 2.90 2.85 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 5 T 8.43 4.82 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 1.24 0.00 0.00 6 L 8.20 4.83 0.00 1.56 1.50 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.35 5.14 0.00 2.70 2.65 0.00 0.00 6.70 7.66 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 8 E 8.33 4.64 0.00 1.86 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 9 V 8.28 4.06 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 0.92 0.00 0.00 0.95 0.00 0.00 10 V 8.12 4.34 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 0.86 0.00 0.00 0.96 0.00 0.00 11 P 0.00 4.57 0.00 2.22 2.30 0.00 4.12 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.08 0.00 12 L 8.68 4.19 0.00 1.74 1.83 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.92 4.14 0.00 1.85 1.89 0.00 1.51 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.45 7.81 14 E 7.82 3.92 0.00 1.16 1.19 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 2.19 2.13 0.00 15 F 8.09 4.94 0.00 3.01 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 16 V 7.44 4.56 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 0.83 0.00 0.00 1.04 0.00 0.00 17 P 0.00 4.57 0.00 2.31 2.07 0.00 3.73 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 2.07 2.14 0.00 18 E 8.79 3.99 0.00 2.01 1.85 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 2.27 2.34 0.00 19 W 8.07 4.67 0.00 3.20 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 20 V 8.34 4.67 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 0.78 0.00 0.00 0.94 0.00 0.00 21 R 8.39 4.67 0.00 1.76 1.78 0.00 3.17 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 22 I 7.61 4.41 1.79 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.51 0.73 0.00 0.00 23 G 7.34 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.38 4.97 0.00 2.85 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 25 S 8.30 4.78 0.00 3.90 3.78 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 26 A 8.08 4.55 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 27 T 8.14 4.75 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 1.20 0.00 0.00 28 T 8.22 4.98 4.57 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 1.40 0.00 0.00 29 G 8.63 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 0.00 0.00 0.00 0.00 30 A 9.33 4.11 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 31 E 7.86 4.50 0.00 1.94 1.72 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 2.07 2.07 0.00 32 F 6.90 5.14 0.00 3.10 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 33 A 8.01 4.41 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.50 4.26 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 35 H 8.64 4.78 0.00 3.04 3.13 0.00 5.84 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.53 4.72 0.00 1.85 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 2.16 2.22 0.00 37 V 7.98 4.25 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 0.46 0.00 0.00 0.06 0.00 0.00 38 L 8.24 4.56 0.00 1.63 1.70 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.57 4.75 0.00 4.04 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 40 W 8.58 5.56 0.00 3.30 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 Y 8.93 4.88 0.00 2.99 2.91 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 42 F 7.30 4.30 0.00 2.40 2.31 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 43 H 6.79 4.42 0.00 2.85 2.90 0.00 5.92 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 44 S 7.98 4.49 0.00 3.91 3.72 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 45 E 8.28 4.37 0.00 1.81 1.76 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 2.17 2.26 0.00 46 L 8.27 4.57 0.00 1.48 1.41 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.83 3.97 1.36 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 0.00 0.00 0.00 48 G 7.97 4.05 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 0.00 0.00 0.00 49 T 7.14 4.49 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 1.20 0.00 0.00 50 S 7.07 4.33 0.00 3.85 3.88 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 0.00 0.00 0.00 0.00 51 S 7.16 4.79 0.00 3.81 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.54 4.55 0.00 2.83 2.88 0.00 0.00 6.29 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