NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 T 4.3670 8.1593 110.9392 61.6694 69.6424 175.7667 11 K 4.4551 8.0644 107.5281 56.1567 33.7143 172.2352 12 N 4.7752 8.1443 122.4762 55.7621 43.5518 174.6492 13 G 4.2522 7.6414 112.5293 45.2632 0.0000 171.8603 14 R 4.5243 7.5273 123.5563 54.7967 33.5922 174.0454 15 D 4.5697 7.9736 122.8106 53.8836 43.6566 176.0068 16 S 4.4360 8.6366 121.2254 57.2994 64.1376 174.1140 17 Q 4.1022 8.4771 121.0581 55.7454 28.9544 176.0681 18 A 4.1093 8.3446 122.0009 52.6979 18.8497 177.9558 19 K 4.1969 8.6036 119.5165 55.9088 33.5707 176.7664 20 R 3.7368 7.7772 116.9471 57.1715 27.3285 174.2794 21 L 4.5212 7.2676 116.8737 52.9513 44.7043 174.9855 22 G 3.6571 8.3565 105.0077 44.6036 0.0000 172.3860 23 V 3.4232 8.0056 118.7162 63.2596 31.5269 176.1446 24 K 4.0702 8.4762 126.9764 58.0774 32.7295 177.3463 25 R 4.6592 7.9372 115.6735 54.4370 32.5244 174.5871 26 Y 5.0877 8.7731 117.1708 55.5755 41.3191 175.0555 27 E 4.4215 9.0359 122.1844 58.1064 30.1248 176.7761 28 G 3.9616 8.9893 113.6781 45.6575 0.0000 172.4491 29 Q 4.7103 7.5966 117.6131 53.4191 30.9389 175.5504 30 V 4.0958 8.5144 124.3770 63.3482 32.4649 175.5239 31 V 4.5583 8.7227 119.5357 59.6668 36.0449 176.3311 32 R 4.5195 8.6800 122.8861 55.9633 31.6381 175.3236 33 A 4.3090 8.3684 122.6973 54.9513 18.5258 177.9024 34 G 4.1586 9.4739 109.7793 45.7867 0.0000 173.1580 35 N 4.2303 8.4103 118.1605 53.3658 38.8855 174.0119 36 I 4.0818 8.3623 124.0307 61.8655 37.5849 175.8288 37 L 4.1759 9.1834 127.4631 57.5380 42.8830 177.9364 38 V 4.3424 7.3713 116.7349 62.0634 34.8529 172.4684 39 R 4.8858 8.2706 126.6158 55.5903 31.7150 175.5283 40 Q 4.8198 8.3088 119.0175 55.3830 31.2005 175.0344 41 R 4.2801 9.0071 119.7984 58.9880 31.9893 177.4567 42 G 4.3094 8.1806 100.4971 46.1831 0.0000 173.8020 43 T 4.4480 8.5387 115.8600 62.5213 69.4041 175.1496 44 R 4.0636 8.2126 121.2922 58.7089 30.5999 177.2546 45 F 4.7992 8.5003 115.5077 55.6940 42.9702 174.5581 46 K 4.3891 9.2748 122.8215 53.0208 34.9238 178.4088 47 P 4.7002 0.0000 0.0000 61.5045 33.1479 179.1700 48 G 4.0452 8.9863 117.6433 45.2939 0.0000 172.3895 49 K 3.9699 8.9112 122.4338 57.2888 32.4609 176.8218 50 N 4.3686 8.8954 123.1614 53.7512 35.7539 174.8098 51 V 4.2265 7.6013 117.2685 61.8859 34.6917 174.3747 52 G 3.9200 7.5782 116.2521 45.1070 0.0000 171.2573 53 M 6.1614 7.8568 115.1121 54.6600 34.2882 174.4900 54 G 4.2171 8.6624 107.5403 44.3566 0.0000 173.7952 55 R 3.9277 8.7955 118.0471 59.2085 29.9405 177.4664 56 D 4.2682 7.8610 114.0347 52.7878 39.6252 176.1696 57 F 4.2015 8.3915 117.0933 59.1288 36.7438 174.8047 58 T 4.2586 8.2275 118.4546 63.5467 69.4375 173.7938 59 L 5.1266 9.0382 127.6717 53.8025 43.7649 175.8158 60 F 5.4689 8.3699 116.7321 55.0982 41.2840 173.6652 61 A 4.2949 8.7611 122.9836 52.7446 18.9631 177.9044 62 L 4.6798 8.4777 118.9764 54.8655 43.8249 176.2321 63 V 4.5828 7.5009 110.0527 60.0269 36.4841 173.7920 64 D 4.9722 9.0456 120.1579 52.0307 42.7256 177.5824 65 G 4.1618 7.0746 108.8079 46.4837 0.0000 171.1702 66 V 5.1171 7.3363 122.3861 59.9791 34.8094 176.1847 67 V 4.3664 8.3437 126.5658 63.0031 33.0195 174.3844 68 E 5.2582 9.2238 123.6145 55.0349 33.2014 173.7623 69 F 5.2034 9.6154 121.2125 56.0029 41.6130 175.4127 70 Q 4.4405 9.1837 123.4438 54.4181 31.7365 173.3601 71 D 4.8531 8.8327 126.8601 53.4528 42.3554 176.7375 72 R 4.6625 8.6323 124.0441 58.4462 32.9620 179.3933 73 G 3.6437 8.5160 108.1149 46.3928 0.0000 175.7591 74 R 3.9677 9.5072 119.9440 59.3944 30.8200 177.9632 75 L 4.0707 8.0298 116.4360 57.7966 42.1686 175.6653 76 G 3.6322 7.5084 102.6338 43.9745 0.0000 171.4388 77 R 4.9511 8.3008 117.4988 55.0981 31.7612 175.7154 78 Y 4.9633 8.9745 121.1325 55.4890 41.6577 174.9362 79 V 4.5423 8.3485 120.2581 61.8078 34.7022 173.9907 80 H 5.0906 9.0663 123.5977 54.1923 33.9717 172.0414 81 V 5.4808 8.6027 119.4104 60.2866 33.4043 175.1711 82 R 4.3908 8.6068 125.4944 54.6029 30.2983 174.3198 83 P 5.1392 0.0000 0.0000 62.1559 32.0761 175.6905 84 L 4.4382 7.9677 119.7153 56.0807 41.9975 173.8671 85 A 4.0965 8.4379 121.9734 53.1674 18.9041 176.3667 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 10 T 8.16 4.37 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 11 K 8.06 4.46 0.00 1.91 1.81 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.52 7.81 12 N 8.14 4.78 0.00 2.70 2.80 0.00 0.00 6.83 7.73 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 13 G 7.64 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 14 R 7.53 4.52 0.00 1.99 1.76 0.00 3.35 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 15 D 7.97 4.57 0.00 2.66 2.50 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 16 S 8.64 4.44 0.00 4.02 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 17 Q 8.48 4.10 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 18 A 8.34 4.11 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 19 K 8.60 4.20 0.00 1.76 1.86 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.39 7.81 20 R 7.78 3.74 0.00 1.92 1.95 0.00 3.19 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 21 L 7.27 4.52 0.00 1.61 1.64 0.94 1.10 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 22 G 8.36 3.66 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 0.00 0.00 0.00 23 V 8.01 3.42 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 0.35 0.00 0.00 0.79 0.00 0.00 24 K 8.48 4.07 0.00 1.77 1.75 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.34 7.81 25 R 7.94 4.66 0.00 1.76 1.79 0.00 3.11 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 26 Y 8.77 5.09 0.00 3.09 2.82 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 27 E 9.04 4.42 0.00 2.50 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 2.43 2.71 0.00 28 G 8.99 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 29 Q 7.60 4.71 0.00 2.33 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 30 V 8.51 4.10 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 0.79 0.00 0.00 0.95 0.00 0.00 31 V 8.72 4.56 2.09 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 1.01 0.00 0.00 1.00 0.00 0.00 32 R 8.68 4.52 0.00 1.91 1.93 0.00 3.37 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 33 A 8.37 4.31 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 34 G 9.47 4.16 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 0.00 35 N 8.41 4.23 0.00 2.82 2.80 0.00 0.00 7.14 7.17 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 36 I 8.36 4.08 1.87 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 1.42 0.44 0.98 0.00 0.00 37 L 9.18 4.18 0.00 1.56 1.59 0.81 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.37 4.34 1.86 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 0.66 0.00 0.00 0.69 0.00 0.00 39 R 8.27 4.89 0.00 1.83 1.82 0.00 3.17 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 40 Q 8.31 4.82 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.07 0.00 0.00 0.00 0.00 0.00 2.49 2.68 0.00 41 R 9.01 4.28 0.00 1.90 2.09 0.00 3.19 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 42 G 8.18 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 0.00 0.00 0.00 0.00 43 T 8.54 4.45 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 1.04 0.00 0.00 44 R 8.21 4.06 0.00 2.18 2.18 0.00 3.22 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 45 F 8.50 4.80 0.00 2.89 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 46 K 9.27 4.39 0.00 0.79 0.89 0.00 0.93 0.00 0.00 1.23 0.00 0.00 2.67 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.04 0.95 7.81 47 P 0.00 4.70 0.00 2.09 1.20 0.00 3.49 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 48 G 8.99 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.91 3.97 0.00 1.79 1.72 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.42 1.21 7.81 50 N 8.90 4.37 0.00 3.00 2.85 0.00 0.00 6.48 7.68 0.00 0.00 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 V 7.60 4.23 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 0.61 0.00 0.00 0.88 0.00 0.00 52 G 7.58 3.92 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 53 M 7.86 6.16 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 54 G 8.66 4.22 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 0.00 55 R 8.80 3.93 0.00 1.71 1.92 0.00 3.16 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 56 D 7.86 4.27 0.00 2.69 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 57 F 8.39 4.20 0.00 3.21 3.19 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 0.00 0.00 0.00 0.00 58 T 8.23 4.26 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 1.28 0.00 0.00 59 L 9.04 5.13 0.00 1.54 1.51 0.97 0.79 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 60 F 8.37 5.47 0.00 3.32 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 61 A 8.76 4.29 1.36 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 0.00 0.00 0.00 62 L 8.48 4.68 0.00 1.50 1.67 0.77 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.50 4.58 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 0.76 0.00 0.00 0.92 0.00 0.00 64 D 9.05 4.97 0.00 2.68 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 65 G 7.07 4.16 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 0.00 66 V 7.34 5.12 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 1.37 0.00 0.00 0.95 0.00 0.00 67 V 8.34 4.37 2.37 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 0.66 0.00 0.00 0.91 0.00 0.00 68 E 9.22 5.26 0.00 2.08 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 2.40 2.39 0.00 69 F 9.62 5.20 0.00 2.95 3.15 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 0.00 70 Q 9.18 4.44 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 71 D 8.83 4.85 0.00 2.74 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 72 R 8.63 4.66 0.00 2.10 1.82 0.00 3.19 0.00 0.00 3.32 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 73 G 8.52 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.51 3.97 0.00 1.82 2.03 0.00 3.38 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 1.65 1.62 0.00 75 L 8.03 4.07 0.00 1.90 2.02 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.51 3.63 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 0.00 0.00 0.00 77 R 8.30 4.95 0.00 1.16 1.60 0.00 2.81 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.40 0.00 78 Y 8.97 4.96 0.00 2.87 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 79 V 8.35 4.54 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 0.02 0.00 0.00 0.91 0.00 0.00 80 H 9.07 5.09 0.00 3.00 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.60 5.48 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 0.80 0.00 0.00 0.89 0.00 0.00 82 R 8.61 4.39 0.00 1.93 2.08 0.00 3.04 0.00 0.00 3.41 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 83 P 0.00 5.14 0.00 2.09 2.10 0.00 3.44 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.80 0.00 84 L 7.97 4.44 0.00 1.73 1.66 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.44 4.10 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