NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4070 0.0000 0.0000 62.5747 32.4688 176.4290 2 L 4.0037 8.3795 119.3789 55.7427 42.0140 174.7342 3 G 4.0871 8.0891 107.0754 44.5773 0.0000 172.8884 4 S 4.2620 8.4050 114.6811 60.5027 63.0896 175.4237 5 V 4.3914 7.3113 118.5715 61.1155 34.2948 174.1195 6 R 4.4251 8.5644 124.9506 55.7233 33.1343 174.7358 7 W 5.6452 7.9456 117.6285 54.9296 33.4935 174.0508 8 A 5.3161 9.5355 125.3117 50.2905 22.7578 174.4393 9 R 4.8803 8.8502 120.5449 54.2733 32.5245 175.5220 10 A 4.1706 8.6359 128.9428 52.4108 18.7061 178.0621 11 L 4.2567 9.1127 123.0090 56.2582 42.5705 176.3513 12 Y 4.9771 7.7304 113.9019 55.9641 42.4140 174.6991 13 D 4.9018 9.0168 120.7768 54.7234 42.0298 175.8888 14 F 4.9632 9.3136 125.0167 56.3350 42.0629 173.2964 15 E 4.3288 8.4088 127.6994 54.8850 30.3136 175.5423 16 A 3.8890 8.1064 130.6816 51.8227 18.9007 176.7607 17 L 4.3031 8.9603 123.9869 55.7848 42.7855 176.6407 18 E 4.7997 7.7332 116.2344 54.0781 33.4141 176.2034 19 E 4.0767 8.7101 119.4558 58.8295 29.7252 177.7873 20 D 4.6571 8.0315 117.2357 53.5046 40.1471 175.1830 21 E 5.2546 8.0189 119.7300 54.9477 31.8609 175.3710 22 L 4.6351 9.1745 126.1710 53.5192 42.9557 176.3507 23 G 3.9619 8.7461 114.1959 46.2831 0.0000 171.4802 24 F 5.2521 8.3771 115.3736 56.1443 41.9263 172.8583 25 R 5.2345 9.4922 118.5840 53.9984 32.9456 176.0625 26 S 4.1999 9.2282 116.6417 60.5756 62.6039 175.1704 27 G 3.9760 9.1163 116.2519 45.0893 0.0000 173.4062 28 E 4.2265 7.9162 120.0431 56.0662 30.9140 176.0774 29 V 4.3876 8.2513 123.4950 62.2859 32.6519 175.1535 30 V 4.4777 9.0870 128.0273 60.8858 34.5870 173.8484 31 E 3.7006 8.7963 128.9470 55.5703 30.6333 175.5016 32 V 4.3884 8.0557 128.7832 61.9324 31.0503 175.5101 33 L 4.1135 8.7872 130.0654 57.3074 42.5514 177.7296 34 D 4.4798 7.7018 118.7134 52.5548 44.4964 175.7718 35 S 3.9395 8.0695 120.2028 57.7120 63.5517 175.3788 36 S 4.1573 7.8684 120.0738 61.9426 62.7054 174.6764 37 N 4.7365 7.9975 118.3717 52.2053 39.3920 172.9082 38 P 4.7106 0.0000 0.0000 64.3108 32.5409 176.6650 39 S 4.3577 9.1596 115.7926 59.2570 64.9838 174.1428 40 W 5.0734 8.4626 118.2408 54.6706 31.5047 175.5036 41 W 5.0481 8.6258 124.8162 55.5784 31.7322 175.0236 42 T 5.1044 8.6409 118.2168 62.0463 70.5081 174.1974 43 G 4.9217 9.6756 112.7433 44.6549 0.0000 171.0217 44 R 5.8607 9.0080 119.4420 53.2707 33.4004 173.8017 45 L 4.8551 8.2868 126.9574 54.3410 45.8943 175.4775 46 H 4.3496 9.5692 122.5538 57.5111 26.3167 174.3611 47 N 4.2785 8.4510 109.8768 53.9772 36.5801 173.8489 48 K 4.6764 7.9908 119.3348 54.6572 34.6479 174.9676 49 L 5.0865 8.5044 127.0741 54.0197 43.3713 175.8790 50 G 4.1072 8.4633 108.3690 46.1535 0.0000 171.9416 51 L 5.3822 8.5891 120.4768 54.1842 43.3246 176.4936 52 F 5.0952 8.7950 116.1965 54.9899 42.1759 171.7253 53 P 3.9417 0.0000 0.0000 61.6787 32.0659 177.5597 54 A 2.7429 8.0018 126.8569 54.8139 18.1427 178.6280 55 N 4.5963 7.6283 109.5029 53.7630 37.8418 175.1033 56 Y 4.7014 8.1902 116.8502 59.1621 38.4193 174.8628 57 V 5.0225 7.6953 111.8669 59.3970 36.3359 174.8261 58 A 4.7115 8.8056 123.2002 49.4080 21.4612 174.0408 59 P 4.7668 0.0000 0.0000 63.8413 31.8720 176.7059 60 M 4.5053 9.0470 124.3203 55.2161 32.7686 176.3275 61 M 4.3274 8.5092 118.4239 55.1533 32.5112 176.4160 62 R 4.1842 8.2930 119.7047 56.6645 30.6246 174.8270 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 P 0.00 4.41 0.00 2.35 2.14 0.00 3.47 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.13 0.00 2 L 8.38 4.00 0.00 1.70 1.72 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.09 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.41 4.26 0.00 3.81 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 5 V 7.31 4.39 1.70 0.00 0.00 0.00 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 0.91 0.00 0.00 6 R 8.56 4.43 0.00 1.76 1.70 0.00 2.88 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.53 0.00 7 W 7.95 5.65 0.00 3.36 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 8 A 9.54 5.32 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.85 4.88 0.00 1.87 1.74 0.00 3.09 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 10 A 8.64 4.17 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 11 L 9.11 4.26 0.00 0.98 0.61 0.86 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.73 4.98 0.00 2.76 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 13 D 9.02 4.90 0.00 2.69 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.31 4.96 0.00 2.63 1.50 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.41 4.33 0.00 1.89 1.63 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 2.08 2.17 0.00 16 A 8.11 3.89 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 17 L 8.96 4.30 0.00 1.69 1.70 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.73 4.80 0.00 2.12 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 2.25 2.33 0.00 19 E 8.71 4.08 0.00 1.94 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 2.31 2.29 0.00 20 D 8.03 4.66 0.00 2.77 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 21 E 8.02 5.25 0.00 2.04 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 0.00 2.34 2.24 0.00 22 L 9.17 4.64 0.00 1.74 1.97 1.08 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.75 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 24 F 8.38 5.25 0.00 3.20 3.16 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 25 R 9.49 5.23 0.00 1.85 1.94 0.00 3.21 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 26 S 9.23 4.20 0.00 3.86 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 27 G 9.12 3.98 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 0.00 0.00 0.00 28 E 7.92 4.23 0.00 1.98 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 2.48 0.00 29 V 8.25 4.39 2.08 0.00 0.00 0.00 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 0.90 0.00 0.00 30 V 9.09 4.48 1.80 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 0.72 0.00 0.00 0.49 0.00 0.00 31 E 8.80 3.70 0.00 1.85 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 1.70 1.47 0.00 32 V 8.06 4.39 1.82 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 0.42 0.00 0.00 1.15 0.00 0.00 33 L 8.79 4.11 0.00 1.65 1.65 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.70 4.48 0.00 2.68 2.39 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 3.94 0.00 2.72 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 36 S 7.87 4.16 0.00 3.95 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 37 N 8.00 4.74 0.00 2.78 3.17 0.00 0.00 6.99 7.69 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 38 P 0.00 4.71 0.00 2.25 2.22 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 39 S 9.16 4.36 0.00 3.89 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 5.07 0.00 3.07 2.97 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 41 W 8.63 5.05 0.00 2.13 2.65 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 0.00 0.00 0.00 0.00 42 T 8.64 5.10 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 1.26 0.00 0.00 43 G 9.68 4.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 9.01 5.86 0.00 1.86 1.74 0.00 3.17 0.00 0.00 3.24 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.42 0.00 45 L 8.29 4.86 0.00 1.79 1.49 0.90 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 46 H 9.57 4.35 0.00 3.36 3.36 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.45 4.28 0.00 2.91 2.93 0.00 0.00 6.93 7.61 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 48 K 7.99 4.68 0.00 1.88 1.94 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.43 7.81 49 L 8.50 5.09 0.00 1.61 1.62 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.46 4.11 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 0.00 51 L 8.59 5.38 0.00 1.63 1.63 0.60 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.79 5.10 0.00 2.77 3.23 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 53 P 0.00 3.94 0.00 1.56 1.24 0.00 2.29 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.91 0.00 54 A 8.00 2.74 -0.01 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 55 N 7.63 4.60 0.00 2.78 2.81 0.00 0.00 6.02 7.55 0.00 0.00 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 Y 8.19 4.70 0.00 3.39 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.70 5.02 2.17 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 0.46 0.00 0.00 1.22 0.00 0.00 58 A 8.81 4.71 1.20 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 59 P 0.00 4.77 0.00 2.05 2.15 0.00 3.80 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 2.26 2.54 0.00 60 M 9.05 4.51 0.00 1.93 2.23 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 2.63 2.53 0.00 61 M 8.51 4.33 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 62 R 8.29 4.18 0.00 1.79 1.81 0.00 3.30 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00