NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0981 8.0544 120.3985 62.9802 32.9539 175.7668 2 D 4.5474 8.3719 126.6562 52.7714 39.9050 175.1432 3 M 4.0869 8.8020 124.3885 57.5161 33.6409 178.6082 4 S 4.1867 8.1639 113.8768 60.8379 63.2029 174.5990 5 N 4.8715 8.4489 116.2840 52.7229 38.7909 173.9742 6 V 3.9147 7.3097 119.2332 62.1809 32.0903 176.0857 7 V 4.1067 8.4047 120.8294 62.6207 32.8531 176.4456 8 K 4.4595 7.5972 120.2970 55.1975 35.6068 174.6814 9 T 4.9974 8.2240 122.6711 61.9289 71.7509 172.7559 10 Y 4.5358 9.0760 123.7278 56.4836 40.3983 174.5415 11 D 4.9934 8.6532 124.9284 52.9386 42.2866 176.0900 12 L 4.6943 8.6987 124.5035 53.8929 42.8554 178.4515 13 Q 3.9383 8.9101 121.4997 59.3404 28.7652 177.9644 14 D 4.5392 8.0305 114.1424 53.3687 39.5128 177.2364 15 G 3.8595 8.4153 109.7129 45.4848 0.0000 173.9770 16 S 4.6384 8.2157 115.0542 58.0364 65.0499 173.2598 17 K 5.0254 9.1248 118.9764 54.6977 36.4466 175.6181 18 V 4.7505 8.6794 124.0572 61.5799 33.8075 173.9725 19 H 5.3373 9.2707 125.0593 53.9387 31.8455 172.9138 20 V 4.8460 8.6341 123.1135 61.2618 33.9531 174.8280 21 F 5.0742 9.1624 126.3583 55.6767 41.0557 177.0876 22 K 3.8861 9.0582 120.9352 59.5931 31.9166 177.9547 23 D 4.6370 8.2458 115.4986 53.1104 39.5524 177.2337 24 G 4.0117 8.3030 109.0704 45.2634 0.0000 174.3549 25 K 4.3849 8.1610 119.3869 56.7871 33.3987 175.7007 26 M 5.4559 8.5501 120.7312 54.3669 35.6498 173.9626 27 G 4.4873 9.3416 110.8882 45.3515 0.0000 170.6445 28 M 5.5956 8.5412 118.0551 53.7177 35.8671 173.3655 29 E 5.3373 9.1260 122.1759 54.4573 33.6192 175.5594 30 N 4.7008 9.2229 120.7233 51.8418 38.6863 175.7832 31 K 3.9552 8.2965 115.8764 58.7732 32.4369 177.4772 32 F 4.6307 8.2851 116.3463 57.0865 39.2627 176.3464 33 G 3.9662 8.4222 109.1814 45.2168 0.0000 173.3744 34 K 4.3219 8.3821 121.9328 55.3723 33.3353 176.3781 35 S 4.7669 8.8061 122.1466 59.0061 63.0695 172.9644 36 M 4.9827 8.6136 124.7977 53.3030 35.4046 175.4149 37 N 4.5113 8.7529 119.2568 53.3852 39.4965 174.8124 38 M 4.1958 8.4394 122.2444 54.0390 32.6475 174.4740 39 P 4.3929 0.0000 0.0000 61.9437 29.9265 175.6616 40 E 4.0933 8.6343 125.3061 57.0154 30.2270 177.1035 41 G 3.8529 9.1420 113.3415 45.8974 0.0000 172.7526 42 K 4.4391 7.1779 120.0828 53.8583 33.6593 176.0445 43 V 4.0431 8.2859 126.6435 63.2582 32.3923 174.8952 44 M 4.8419 9.1087 126.9980 53.5002 35.9217 173.8311 45 E 5.0672 8.7125 123.8959 54.9488 32.1278 175.4310 46 T 4.8046 9.0562 117.3965 60.5725 70.6683 176.0442 47 R 4.0851 8.9681 121.7383 58.8723 30.0883 177.7216 48 D 4.6686 7.7201 114.9467 52.9228 39.4487 177.4865 49 G 3.9915 8.1579 109.2704 45.5709 0.0000 174.5720 50 T 4.1212 8.0999 116.9136 63.7706 69.8568 173.3900 51 K 5.2221 8.6758 123.4111 54.6586 35.4932 175.1199 52 I 5.2117 8.9968 116.4650 59.2991 41.6708 174.1270 53 I 5.0240 8.8262 122.9747 59.9537 41.6327 174.1501 54 M 5.0997 8.5302 125.2369 53.6727 34.2666 175.2384 55 K 4.8038 9.3150 124.2962 56.1457 35.6749 175.9353 56 G 3.7072 9.7925 115.0828 46.9429 0.0000 173.0036 57 N 4.2673 8.6348 113.1123 53.9599 37.7795 172.9683 58 E 4.7595 8.0244 114.1025 53.9364 33.0221 174.5729 59 I 4.8467 8.0683 121.7561 59.8702 38.9894 174.9626 60 F 4.8149 9.4781 126.1430 55.6552 41.3500 174.7147 61 R 5.1417 8.4927 122.6067 53.9520 32.9521 174.9680 62 L 4.0329 8.4686 124.7789 55.2602 42.6964 176.7839 63 D 4.4023 8.7797 122.5503 53.9192 41.0453 176.3945 64 E 3.9826 8.8572 128.4057 58.7967 29.8699 177.7930 65 A 4.1045 8.2352 121.0698 54.2872 18.6836 177.2813 66 L 4.2978 7.8157 119.9860 54.9662 41.8345 176.3011 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 V 8.05 4.10 2.02 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 0.86 0.00 0.00 0.97 0.00 0.00 2 D 8.37 4.55 0.00 2.94 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 M 8.80 4.09 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 4 S 8.16 4.19 0.00 3.88 3.95 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 5 N 8.45 4.87 0.00 2.95 3.00 0.00 0.00 6.45 7.28 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 6 V 7.31 3.91 2.02 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 0.56 0.00 0.00 0.33 0.00 0.00 7 V 8.40 4.11 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 0.70 0.00 0.00 0.97 0.00 0.00 8 K 7.60 4.46 0.00 1.64 1.42 0.00 1.46 0.00 0.00 1.61 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.51 1.07 7.81 9 T 8.22 5.00 4.15 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 1.19 0.00 0.00 10 Y 9.08 4.54 0.00 2.77 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.65 4.99 0.00 2.59 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.69 0.00 1.81 1.57 0.91 0.86 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 13 Q 8.91 3.94 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.22 0.00 0.00 0.00 0.00 0.00 2.68 2.46 0.00 14 D 8.03 4.54 0.00 2.76 2.76 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 0.00 0.00 0.00 15 G 8.42 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 0.00 0.00 0.00 16 S 8.22 4.64 0.00 4.05 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 17 K 9.12 5.03 0.00 1.58 1.46 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.34 7.81 18 V 8.68 4.75 2.19 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 1.03 0.00 0.00 0.91 0.00 0.00 19 H 9.27 5.34 0.00 2.99 2.69 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.63 4.85 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 1.10 0.00 0.00 1.10 0.00 0.00 21 F 9.16 5.07 0.00 3.21 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 22 K 9.06 3.89 0.00 1.80 1.93 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.50 1.63 7.81 23 D 8.25 4.64 0.00 2.79 2.78 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 24 G 8.30 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 25 K 8.16 4.38 0.00 1.78 1.72 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.48 7.81 26 M 8.55 5.46 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 27 G 9.34 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.54 5.60 0.00 2.23 1.87 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.54 0.00 29 E 9.13 5.34 0.00 2.08 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 0.00 2.26 2.27 0.00 30 N 9.22 4.70 0.00 2.97 3.09 0.00 0.00 6.63 7.27 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 31 K 8.30 3.96 0.00 1.54 1.85 0.00 0.61 0.00 0.00 1.81 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.92 0.21 7.81 32 F 8.29 4.63 0.00 3.25 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 33 G 8.42 3.97 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 0.00 0.00 0.00 34 K 8.38 4.32 0.00 1.96 1.91 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.42 7.81 35 S 8.81 4.77 0.00 3.96 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 36 M 8.61 4.98 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.52 0.00 37 N 8.75 4.51 0.00 2.72 2.76 0.00 0.00 7.01 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 38 M 8.44 4.20 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 39 P 0.00 4.39 0.00 2.17 2.10 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 40 E 8.63 4.09 0.00 2.03 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 2.37 2.51 0.00 41 G 9.14 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 0.00 0.00 0.00 42 K 7.18 4.44 0.00 1.78 1.82 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.33 7.81 43 V 8.29 4.04 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 0.82 0.00 0.00 0.91 0.00 0.00 44 M 9.11 4.84 0.00 1.92 1.84 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.43 0.00 45 E 8.71 5.07 0.00 2.04 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 0.00 2.30 2.41 0.00 46 T 9.06 4.80 4.41 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 1.33 0.00 0.00 47 R 8.97 4.09 0.00 1.79 2.04 0.00 3.14 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 48 D 7.72 4.67 0.00 2.91 2.75 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 0.00 0.00 0.00 49 G 8.16 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.10 4.12 4.31 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 1.28 0.00 0.00 51 K 8.68 5.22 0.00 1.68 1.67 0.00 1.61 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.40 7.81 52 I 9.00 5.21 1.66 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.86 0.80 0.00 0.00 53 I 8.83 5.02 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.65 0.83 0.00 0.00 54 M 8.53 5.10 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 55 K 9.32 4.80 0.00 1.65 1.57 0.00 1.67 0.00 0.00 1.46 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.52 7.81 56 G 9.79 3.71 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 0.00 0.00 0.00 57 N 8.63 4.27 0.00 2.86 2.90 0.00 0.00 7.00 7.65 0.00 0.00 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 E 8.02 4.76 0.00 2.20 1.54 0.00 0.00 0.00 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 2.47 0.00 59 I 8.07 4.85 1.82 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.71 0.52 0.00 0.00 60 F 9.48 4.81 0.00 2.80 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 61 R 8.49 5.14 0.00 1.83 1.80 0.00 3.34 0.00 0.00 3.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 62 L 8.47 4.03 0.00 1.60 1.64 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.78 4.40 0.00 2.70 2.59 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 64 E 8.86 3.98 0.00 1.98 1.98 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 2.30 2.32 0.00 65 A 8.24 4.10 1.33 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 0.00 0.00 66 L 7.82 4.30 0.00 1.66 1.58 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00