NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.5678 8.1200 121.8626 55.6740 34.2391 174.4533 3 V 5.0818 7.7744 117.5412 58.1099 34.0254 173.2540 4 R 4.5315 8.4488 123.8526 55.4256 33.1325 174.1424 5 A 4.2364 8.4506 118.8295 52.9375 19.7047 177.2003 6 S 4.4848 7.6927 109.8867 56.2174 62.2787 171.3848 7 V 3.9891 7.9048 123.8285 61.2032 32.1697 175.2498 8 K 4.6364 7.7480 124.6637 54.2021 35.5813 175.8716 9 R 4.1954 8.3678 119.2424 56.1807 29.9240 176.5197 10 I 4.1664 8.0676 123.7525 60.1908 37.2150 174.8626 11 C 4.8110 7.1719 120.4487 59.5293 34.1571 172.8652 12 D 4.5273 7.9141 119.4809 55.3616 39.5642 177.7849 13 K 4.3265 7.9611 117.9441 56.8146 32.0679 176.0890 14 C 4.7601 7.2426 116.5791 58.5948 30.0165 172.9069 15 K 4.4003 8.1232 118.8829 55.6560 35.3211 174.5611 16 V 3.9341 8.5662 128.0253 62.2445 31.8307 175.0774 17 I 4.2505 8.1818 129.5966 59.7330 38.9150 175.3173 18 R 4.9818 8.6818 129.5779 54.6782 29.1036 174.5105 19 R 4.6018 8.2450 119.8391 55.1905 32.1163 175.9333 20 H 3.8940 9.1539 117.4577 57.1746 25.3255 177.5862 21 G 4.0577 8.3781 106.7687 46.1584 0.0000 174.6131 22 R 4.4646 7.8794 118.8480 54.7695 31.9762 175.5401 23 V 4.4160 8.1089 120.8827 62.3422 32.3866 174.6305 24 Y 5.0972 8.7794 127.6109 57.2541 41.4896 174.8742 25 V 5.3209 8.5255 117.7645 63.7004 34.8711 172.6824 26 I 4.9134 8.4227 121.3730 59.7627 41.0978 174.2435 27 C 4.9652 8.0432 121.4403 58.8017 34.0697 172.7937 28 E 4.0364 9.0557 119.0392 59.1522 29.7811 176.9679 29 N 4.7005 7.9242 116.6857 50.9667 38.4567 174.0460 30 P 4.4295 0.0000 0.0000 64.7947 31.5150 178.2404 31 K 4.0225 7.3701 116.4188 59.0877 32.0497 177.2005 32 H 4.9724 7.9404 114.3980 55.3511 29.2465 174.7681 33 K 4.5288 7.9037 122.2579 56.1552 33.0734 175.7197 34 Q 5.0041 8.9713 126.5215 54.0445 32.9865 174.5960 35 R 4.3445 8.9364 122.6837 54.1511 33.2754 173.9397 36 Q 4.3472 8.6832 128.8095 56.3242 29.5770 175.9630 37 G 3.8226 8.7414 113.9424 47.1447 0.0000 172.6889 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 2 K 8.12 4.57 0.00 1.82 1.81 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.23 7.81 3 V 7.77 5.08 2.05 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 0.61 0.00 0.00 0.88 0.00 0.00 4 R 8.45 4.53 0.00 1.95 1.97 0.00 2.99 0.00 0.00 3.41 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 5 A 8.45 4.24 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 6 S 7.69 4.48 0.00 3.78 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 7 V 7.90 3.99 2.05 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 0.88 0.00 0.00 0.89 0.00 0.00 8 K 7.75 4.64 0.00 1.74 1.65 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.35 7.81 9 R 8.37 4.20 0.00 1.79 1.88 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 10 I 8.07 4.17 1.34 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.54 0.73 0.00 0.00 11 C 7.17 4.81 0.00 2.96 2.86 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 12 D 7.91 4.53 0.00 2.87 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 13 K 7.96 4.33 0.00 1.86 1.87 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.47 7.81 14 C 7.24 4.76 0.00 3.14 2.88 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 15 K 8.12 4.40 0.00 1.81 1.61 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.43 7.81 16 V 8.57 3.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.94 0.00 0.00 17 I 8.18 4.25 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.80 0.87 0.00 0.00 18 R 8.68 4.98 0.00 1.86 1.90 0.00 3.20 0.00 0.00 3.30 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 19 R 8.24 4.60 0.00 1.89 1.78 0.00 2.66 0.00 0.00 2.99 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.07 0.00 20 H 9.15 3.89 0.00 3.51 3.58 0.00 5.92 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.38 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 0.00 0.00 0.00 22 R 7.88 4.46 0.00 2.43 1.82 0.00 3.32 0.00 0.00 3.08 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 23 V 8.11 4.42 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 1.02 0.00 0.00 0.99 0.00 0.00 24 Y 8.78 5.10 0.00 3.12 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.53 5.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.95 0.00 0.00 26 I 8.42 4.91 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.72 0.94 0.00 0.00 27 C 8.04 4.97 0.00 2.99 2.88 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 28 E 9.06 4.04 0.00 1.98 1.96 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 2.29 2.24 0.00 29 N 7.92 4.70 0.00 2.93 2.89 0.00 0.00 5.89 7.76 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 30 P 0.00 4.43 0.00 2.24 2.35 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 31 K 7.37 4.02 0.00 1.79 1.87 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.39 7.81 32 H 7.94 4.97 0.00 3.13 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.90 4.53 0.00 1.95 1.73 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.48 7.81 34 Q 8.97 5.00 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 35 R 8.94 4.34 0.00 1.39 1.47 0.00 2.87 0.00 0.00 2.92 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.50 0.00 36 Q 8.68 4.35 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 37 G 8.74 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 0.00 0.00 0.00