NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 47 A 4.1402 8.2531 123.5821 54.7414 18.6234 173.9142 48 G 3.0036 7.6982 110.9081 44.9402 0.0000 168.9580 49 A 4.6952 8.0750 128.4175 50.4990 23.2273 174.3087 50 G 4.2730 9.1483 107.3225 45.2508 0.0000 173.6831 51 K 4.2074 7.2600 114.7462 55.5964 35.1491 173.8682 52 A 4.6502 9.3126 128.2733 50.5566 19.9756 177.9261 53 G 4.7453 7.0104 119.0863 47.0638 0.0000 173.6323 54 E 4.3181 7.6188 121.0188 55.6742 29.2439 176.4664 55 G 4.0619 8.1066 108.5369 45.2668 0.0000 172.9476 56 E 4.6059 7.8016 119.1473 56.1527 31.2216 176.3339 57 I 4.3647 9.0669 126.0830 59.9309 38.0313 173.6532 58 P 4.9656 0.0000 0.0000 62.4298 32.1696 176.3215 59 A 4.3233 8.4979 125.0041 51.2444 19.0450 176.9935 60 P 4.2429 0.0000 0.0000 65.2783 31.8693 175.7329 61 L 4.1347 7.1738 116.2831 54.6709 42.4490 173.6733 62 A 4.6468 7.9878 120.8936 51.0539 18.2988 176.8237 63 G 4.2549 8.4955 107.5226 45.6293 0.0000 169.6891 64 T 4.9962 7.9935 115.6545 61.3672 71.1897 174.7813 65 V 3.8667 8.9682 127.0531 63.6148 32.0429 175.5646 66 S 4.4275 8.8851 122.8968 59.5815 63.3265 173.8881 67 K 4.6733 7.7247 119.2678 55.0952 35.6945 173.7659 68 I 4.5930 8.3187 126.4170 60.1052 38.4879 175.1875 69 L 4.4262 8.5284 126.5343 56.5575 42.7343 177.9435 70 V 4.1333 7.6820 110.2979 60.2270 32.9715 175.2408 71 K 4.5754 8.0162 120.1596 54.5208 35.6349 175.0979 72 E 5.1188 8.1514 119.7533 59.5401 28.4759 174.7613 73 G 3.5665 8.3353 121.0706 45.5930 0.0000 171.9444 74 D 4.7279 8.0616 121.0629 54.0581 42.4051 176.0325 75 T 4.8261 8.3569 118.0154 62.6354 70.2828 174.4401 76 V 4.6111 8.9193 117.9229 59.5124 35.9392 174.5827 77 K 4.9154 8.2744 119.7645 54.2286 35.9884 175.5380 78 A 4.4716 8.8140 125.2114 54.6598 16.8082 175.4477 79 G 3.4183 8.1745 115.3345 46.3177 0.0000 172.6004 80 Q 4.1557 8.0649 122.7757 56.0457 30.2428 176.1631 81 T 4.7027 8.4203 122.0121 63.6681 68.8059 174.4041 82 V 4.3406 9.3270 119.1785 62.2787 34.9671 175.3750 83 L 4.7102 7.5907 119.0249 54.0855 45.6455 173.5546 84 V 4.7938 8.5636 124.7475 61.3383 33.6040 174.3809 85 L 5.1600 9.1007 127.7062 53.2175 44.9989 175.7726 86 E 5.3508 9.9357 124.6968 54.2918 29.4416 172.9563 87 A 4.5760 8.1587 124.7977 50.3880 20.7589 176.8452 88 M 3.0344 8.5869 123.8750 58.1352 28.9744 176.7754 89 K 3.8505 7.8933 109.1916 57.8336 32.6245 174.8885 90 M 4.7482 7.5917 116.0451 54.7640 35.7198 173.8396 91 E 4.3636 9.0122 126.0875 56.7993 30.4947 176.2294 92 T 4.6331 9.2640 122.3399 61.6191 71.5908 173.2638 93 E 4.5444 8.8615 126.1404 55.9175 30.8072 175.9156 94 I 4.3728 8.4999 125.5232 59.9154 38.8946 174.3806 95 N 5.3641 8.5649 124.3764 51.1114 41.1461 174.5686 96 A 4.1572 8.6132 124.7502 51.6220 19.1450 177.1985 97 P 4.2292 0.0000 0.0000 65.4207 31.9107 176.5632 98 T 4.7174 7.3407 106.0721 59.2143 71.7701 172.8525 99 D 4.6268 8.7066 122.1056 52.9249 40.6468 177.0948 100 G 3.9836 7.5298 107.4859 46.0662 0.0000 171.1286 101 K 4.8101 7.7190 119.8243 54.3463 36.5508 177.1935 102 V 4.2449 8.4828 126.4814 63.0492 31.3807 175.9041 103 E 4.3481 8.7251 127.4305 57.9095 31.0803 176.8652 104 K 4.4186 7.7358 120.1995 55.2078 35.9275 174.5262 105 V 4.2954 8.4530 127.9091 61.2499 32.1824 174.6617 106 L 4.6961 8.1493 129.2061 54.5215 42.0737 177.5063 107 V 4.4490 7.5421 110.3038 60.2957 35.5525 173.6105 108 K 4.7349 8.2112 122.0631 53.9480 35.9427 175.8235 109 E 4.0405 8.5509 119.4060 57.8601 29.7534 177.0790 110 R 3.8879 8.3332 118.7904 57.4561 28.5032 175.5733 111 D 5.0346 7.9091 115.6932 52.3572 44.4244 174.0469 112 A 4.8319 8.6162 126.9722 51.0665 20.2253 176.7491 113 V 4.5196 8.4881 114.6193 59.6546 35.5801 174.9580 114 Q 4.6188 8.4647 121.6351 53.9855 31.3159 175.4998 115 G 3.8090 8.5478 111.4997 47.9622 0.0000 172.6203 116 G 4.0837 8.9375 114.4468 45.4302 0.0000 173.3053 117 Q 4.2466 8.1966 121.3556 55.8443 30.2433 176.2293 118 G 3.8563 8.7056 113.4195 47.2420 0.0000 172.8618 119 L 4.4969 9.3663 126.6036 56.9250 43.0100 177.0034 120 I 4.8593 7.4319 117.8766 59.4506 42.2019 173.6572 121 K 4.7516 8.9660 127.3440 55.3490 33.5358 175.2012 122 I 4.8469 8.3497 128.5049 59.5466 39.4704 176.0671 123 G 3.8041 8.7949 112.1890 46.3777 0.0000 172.9115 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 47 A 8.25 4.14 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 48 G 7.70 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 0.00 0.00 0.00 49 A 8.08 4.70 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.15 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 0.00 0.00 0.00 0.00 51 K 7.26 4.21 0.00 1.66 1.62 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.42 7.81 52 A 9.31 4.65 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.01 4.75 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 0.00 0.00 0.00 54 E 7.62 4.32 0.00 1.97 1.95 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 2.27 2.29 0.00 55 G 8.11 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 56 E 7.80 4.61 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 57 I 9.07 4.36 1.87 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 1.28 0.78 0.91 0.00 0.00 58 P 0.00 4.97 0.00 2.07 2.13 0.00 3.76 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 59 A 8.50 4.32 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.24 0.00 2.19 2.19 0.00 3.80 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 1.98 1.95 0.00 61 L 7.17 4.13 0.00 1.69 1.66 0.92 0.46 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 62 A 7.99 4.65 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.50 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.99 5.00 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 1.21 0.00 0.00 65 V 8.97 3.87 2.30 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 0.98 0.00 0.00 0.98 0.00 0.00 66 S 8.89 4.43 0.00 3.92 3.84 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 67 K 7.72 4.67 0.00 1.82 1.56 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.47 7.81 68 I 8.32 4.59 1.87 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 0.61 0.98 0.00 0.00 69 L 8.53 4.43 0.00 1.69 1.70 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.68 4.13 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 0.97 0.00 0.00 71 K 8.02 4.58 0.00 1.86 1.84 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.44 7.81 72 E 8.15 5.12 0.00 1.95 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 2.37 2.35 0.00 73 G 8.34 3.57 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 0.00 0.00 0.00 74 D 8.06 4.73 0.00 2.70 2.58 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 75 T 8.36 4.83 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 1.25 0.00 0.00 76 V 8.92 4.61 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 0.90 0.00 0.00 0.96 0.00 0.00 77 K 8.27 4.92 0.00 1.66 1.65 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.40 7.81 78 A 8.81 4.47 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 79 G 8.17 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.06 4.16 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 81 T 8.42 4.70 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 1.24 0.00 0.00 82 V 9.33 4.34 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 0.87 0.00 0.00 0.97 0.00 0.00 83 L 7.59 4.71 0.00 1.68 1.44 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.56 4.79 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 0.90 0.00 0.00 0.93 0.00 0.00 85 L 9.10 5.16 0.00 1.55 1.51 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 86 E 9.94 5.35 0.00 1.86 1.89 0.00 0.00 0.00 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 2.09 0.00 87 A 8.16 4.58 1.24 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 0.00 0.00 0.00 88 M 8.59 3.03 0.00 2.18 2.14 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 2.50 2.51 0.00 89 K 7.89 3.85 0.00 1.94 1.91 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.40 7.81 90 M 7.59 4.75 0.00 2.23 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 91 E 9.01 4.36 0.00 1.89 1.89 0.00 0.00 0.00 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 2.34 0.00 92 T 9.26 4.63 4.28 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 1.21 0.00 0.00 93 E 8.86 4.54 0.00 1.83 1.88 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 2.29 2.40 0.00 94 I 8.50 4.37 1.99 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 1.30 0.91 0.00 0.00 95 N 8.56 5.36 0.00 2.63 2.72 0.00 0.00 6.98 7.54 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 96 A 8.61 4.16 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 97 P 0.00 4.23 0.00 2.19 2.19 0.00 3.74 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 1.98 1.95 0.00 98 T 7.34 4.72 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 1.21 0.00 0.00 99 D 8.71 4.63 0.00 2.79 2.71 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 0.00 100 G 7.53 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 0.00 101 K 7.72 4.81 0.00 1.79 1.59 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.39 7.81 102 V 8.48 4.24 2.30 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 0.98 0.00 0.00 0.97 0.00 0.00 103 E 8.73 4.35 0.00 2.04 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 2.39 2.24 0.00 104 K 7.74 4.42 0.00 1.82 1.64 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.43 7.81 105 V 8.45 4.30 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 0.87 0.00 0.00 0.93 0.00 0.00 106 L 8.15 4.70 0.00 1.78 1.66 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.54 4.45 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 0.78 0.00 0.00 0.96 0.00 0.00 108 K 8.21 4.73 0.00 1.68 1.67 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.36 7.81 109 E 8.55 4.04 0.00 1.95 1.89 0.00 0.00 0.00 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 2.33 0.00 110 R 8.33 3.89 0.00 1.99 2.01 0.00 3.26 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 111 D 7.91 5.03 0.00 2.84 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.62 4.83 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.49 4.52 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 0.99 0.00 0.00 0.97 0.00 0.00 114 Q 8.46 4.62 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 115 G 8.55 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.94 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.20 4.25 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 118 G 8.71 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 0.00 119 L 9.37 4.50 0.00 1.61 1.71 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.43 4.86 1.87 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 1.23 0.94 0.93 0.00 0.00 121 K 8.97 4.75 0.00 1.82 1.67 0.00 1.60 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.40 7.81 122 I 8.35 4.85 1.87 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 1.16 1.01 0.99 0.00 0.00 123 G 8.79 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