NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1679 8.1233 122.3734 51.4710 20.7627 175.3313 2 W 5.1600 8.9646 119.2325 54.4355 32.8953 173.2849 3 K 4.9751 9.3168 121.5654 54.7502 36.0407 175.6967 4 V 4.5881 8.4611 123.5847 62.5439 33.1037 175.2183 5 S 4.7824 9.2098 120.8694 56.8051 67.4418 173.1132 6 V 4.7595 8.3682 123.3320 60.9004 33.6678 174.3999 7 D 4.4838 9.0148 129.1076 54.2770 41.2133 177.0734 8 Q 4.0633 8.8458 126.2939 58.8347 29.0201 177.3012 9 D 4.5863 8.0634 115.5779 55.7832 41.3356 176.9915 10 T 4.3127 7.7398 114.7796 64.9523 69.9836 175.0018 11 C 3.9860 7.9074 120.6067 60.0938 31.7489 173.1562 12 I 4.2745 8.3374 118.3445 59.9652 37.6339 175.3054 13 G 3.9992 8.0050 107.0828 46.3704 0.0000 175.1368 14 D 4.2016 8.3170 120.2219 55.9093 41.6510 176.9168 15 A 3.7805 8.1411 118.9541 52.6418 16.1994 179.1170 16 I 3.7474 7.2729 118.3354 64.1222 37.8532 177.9502 17 C 3.7699 7.7656 115.1855 61.2041 29.2393 175.6184 18 A 4.1166 7.7335 121.8683 54.5172 18.0270 179.0565 19 S 4.1560 7.8524 111.0636 61.8382 62.6127 176.2777 20 L 4.2009 7.9317 120.5980 56.9567 42.9037 177.2408 21 C 5.0013 8.2558 118.1448 54.7273 43.9202 172.5286 22 P 4.3761 0.0000 0.0000 64.8590 31.7769 178.2591 23 D 4.4905 8.0896 118.1690 56.1977 41.4223 176.7310 24 V 4.0736 7.8588 118.0480 63.1892 34.1284 175.2395 25 F 5.4676 8.4528 118.0199 55.4903 41.2162 175.0898 26 E 4.9018 9.0530 119.7740 54.7968 33.3154 174.5097 27 M 4.9347 8.6483 120.0495 54.6020 33.7577 175.5295 28 N 4.9898 8.7159 119.7129 50.9670 40.0111 174.9234 29 D 4.5434 8.5427 116.2977 56.0891 40.8869 176.9995 30 E 4.3301 8.3456 117.6937 55.7020 30.0081 176.3226 31 G 3.8829 8.3937 107.7249 46.1613 0.0000 173.5049 32 K 4.5135 8.0402 117.9296 53.9484 34.7498 175.6745 33 A 5.1078 8.2532 122.6770 52.0875 19.9183 176.5718 34 Q 4.8059 9.0178 116.6401 54.1044 32.5412 172.0671 35 P 4.7367 0.0000 0.0000 62.9654 31.6300 176.5916 36 K 4.2783 9.0362 122.4804 58.0262 32.6613 177.6481 37 V 4.4851 7.4067 111.8363 59.6396 35.2111 175.1910 38 E 4.3847 8.6972 121.1088 56.9996 30.1637 176.4331 39 V 4.7163 7.2984 116.8948 61.4105 34.7535 173.1253 40 I 4.6997 9.1579 126.0361 59.7393 39.5968 176.1717 41 E 4.6023 8.8044 122.9207 56.3756 31.9986 176.4508 42 D 4.5139 8.1319 119.0516 53.9961 42.1717 176.2372 43 E 4.0715 9.0221 127.0663 59.6680 29.6223 178.9471 44 E 3.9530 8.6131 119.3348 59.1990 29.6160 178.9378 45 L 3.9743 8.1077 118.6493 57.7243 41.7378 178.4520 46 Y 3.7931 8.2162 119.8540 60.8435 38.5972 178.0398 47 N 3.8633 8.3202 117.8295 56.2652 38.6190 174.8609 48 C 4.3462 8.2620 114.9728 57.6611 40.4794 175.8898 49 A 4.0891 8.0176 124.1653 55.0993 18.0030 179.4534 50 K 3.6956 7.6604 118.2934 59.3490 31.9159 178.5823 51 E 3.8256 7.7906 118.6374 59.1593 29.9805 178.4058 52 A 3.9656 7.9389 120.7699 55.2670 17.9566 179.0887 53 M 3.9165 8.3152 117.1288 59.0814 32.0637 178.3411 54 E 3.7130 8.1229 116.8247 58.5650 29.6847 178.3204 55 A 4.3244 7.4328 119.1504 52.2849 19.1672 177.2746 56 C 3.9915 7.0789 118.9541 59.0806 31.8678 172.6671 57 P 4.4176 0.0000 0.0000 64.5403 31.3246 177.1073 58 V 4.2228 7.4943 110.3010 60.2999 32.8078 175.2745 59 S 3.6404 7.5582 113.6940 59.7127 60.5852 172.7816 60 A 4.3594 7.7245 120.7152 53.0852 20.1326 178.1964 61 I 5.0558 7.6836 116.2515 59.6624 39.3282 175.2665 62 T 4.8629 8.9276 115.7186 59.9410 72.5398 172.7116 63 I 5.0675 8.3899 122.5374 59.6676 40.3980 174.2575 64 E 4.8062 9.4275 128.2980 54.5047 32.0184 174.1922 65 E 4.9480 8.8890 125.2220 54.6000 31.8913 175.7669 66 A 4.2510 8.1026 124.3725 52.1019 19.0298 175.7979 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 A 8.12 4.17 1.17 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 0.00 0.00 0.00 2 W 8.96 5.16 0.00 3.40 3.02 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 3 K 9.32 4.98 0.00 1.75 1.68 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.69 7.81 4 V 8.46 4.59 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 0.82 0.00 0.00 0.89 0.00 0.00 5 S 9.21 4.78 0.00 3.79 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 6 V 8.37 4.76 2.26 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 0.84 0.00 0.00 1.17 0.00 0.00 7 D 9.01 4.48 0.00 2.79 2.57 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 0.00 8 Q 8.85 4.06 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 9 D 8.06 4.59 0.00 2.78 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 10 T 7.74 4.31 4.36 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 1.22 0.00 0.00 11 C 7.91 3.99 0.00 3.03 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 I 8.34 4.27 1.86 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 1.33 0.79 0.96 0.00 0.00 13 G 8.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.32 4.20 0.00 2.61 2.66 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 0.00 0.00 0.00 0.00 15 A 8.14 3.78 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 16 I 7.27 3.75 1.91 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.83 0.00 0.00 17 C 7.77 3.77 0.00 1.70 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.73 4.12 1.38 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 0.00 0.00 19 S 7.85 4.16 0.00 3.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 4.20 0.00 1.59 1.69 0.88 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.26 5.00 0.00 3.02 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 22 P 0.00 4.38 0.00 2.24 2.30 0.00 3.84 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 23 D 8.09 4.49 0.00 2.69 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 24 V 7.86 4.07 1.83 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 0.22 0.00 0.00 0.83 0.00 0.00 25 F 8.45 5.47 0.00 2.92 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 26 E 9.05 4.90 0.00 2.03 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 0.00 2.34 2.28 0.00 27 M 8.65 4.93 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 28 N 8.72 4.99 0.00 2.92 3.06 0.00 0.00 6.98 8.54 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 29 D 8.54 4.54 0.00 2.70 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 30 E 8.35 4.33 0.00 2.10 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 2.25 2.35 0.00 31 G 8.39 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 0.00 0.00 0.00 32 K 8.04 4.51 0.00 2.01 1.71 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.50 7.81 33 A 8.25 5.11 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.02 4.81 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 35 P 0.00 4.74 0.00 2.16 1.93 0.00 3.51 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 1.97 2.22 0.00 36 K 9.04 4.28 0.00 1.57 1.88 0.00 1.65 0.00 0.00 2.01 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.41 7.81 37 V 7.41 4.49 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 0.72 0.00 0.00 0.91 0.00 0.00 38 E 8.70 4.38 0.00 1.93 1.99 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 2.26 2.34 0.00 39 V 7.30 4.72 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 0.84 0.00 0.00 0.94 0.00 0.00 40 I 9.16 4.70 2.15 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 1.34 0.64 1.14 0.00 0.00 41 E 8.80 4.60 0.00 1.97 2.00 0.00 0.00 0.00 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 2.27 0.00 42 D 8.13 4.51 0.00 2.76 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.02 4.07 0.00 2.18 2.06 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 2.50 2.56 0.00 44 E 8.61 3.95 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 45 L 8.11 3.97 0.00 1.92 1.69 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.22 3.79 0.00 2.25 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 47 N 8.32 3.86 0.00 2.81 2.74 0.00 0.00 6.86 7.20 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 48 C 8.26 4.35 0.00 3.14 3.30 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 49 A 8.02 4.09 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 50 K 7.66 3.70 0.00 1.25 1.52 0.00 1.64 0.00 0.00 1.49 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.13 1.21 7.81 51 E 7.79 3.83 0.00 2.04 2.01 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 2.26 2.27 0.00 52 A 7.94 3.97 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 53 M 8.32 3.92 0.00 2.17 2.10 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 2.77 2.58 0.00 54 E 8.12 3.71 0.00 2.06 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 2.31 2.40 0.00 55 A 7.43 4.32 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.08 3.99 0.00 2.68 2.77 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 0.00 0.00 0.00 57 P 0.00 4.42 0.00 2.19 2.13 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.20 0.00 58 V 7.49 4.22 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 0.75 0.00 0.00 0.97 0.00 0.00 59 S 7.56 3.64 0.00 4.02 3.91 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 60 A 7.72 4.36 1.27 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 0.00 0.00 61 I 7.68 5.06 1.87 0.00 0.00 0.51 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 1.11 0.00 0.00 62 T 8.93 4.86 4.29 0.00 0.00 0.00 0.00 0.00 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 63 I 8.39 5.07 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 1.15 0.00 0.00 64 E 9.43 4.81 0.00 2.08 1.84 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 2.23 2.29 0.00 65 E 8.89 4.95 0.00 1.84 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.59 0.00 66 A 8.10 4.25 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00