NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 H 4.5770 8.4331 116.3231 54.5336 30.4545 173.1470 0 G 3.9021 9.5769 114.2117 43.0675 0.0000 172.0677 1 S 4.5461 7.7142 114.6516 56.3126 66.6596 173.8252 2 A 4.0691 8.5333 123.3386 54.9649 18.2137 179.9290 3 S 4.0292 7.4179 111.3150 60.8109 62.8039 175.1306 4 F 4.5663 7.9902 116.9744 56.9480 39.3185 175.4481 5 L 4.6137 7.5082 121.2663 52.6926 42.9185 176.7131 6 K 4.1038 8.5965 121.7798 56.6509 32.6778 177.2020 7 K 4.2031 8.9382 125.6022 58.8574 32.5754 176.5289 8 T 5.0198 7.5740 105.6463 59.9579 72.0424 172.3849 9 M 4.9409 8.9182 122.2053 53.4598 35.7214 172.8370 10 P 5.2106 0.0000 0.0000 62.4443 33.3383 174.7155 11 F 5.1745 8.5822 114.4495 55.6467 41.6480 173.3430 12 K 5.1703 8.7508 117.7272 55.2012 36.1063 175.9021 13 T 4.9800 9.1243 119.0781 62.0265 72.9861 172.9899 14 T 5.1492 8.5741 113.8267 60.0429 71.8196 173.1108 15 I 4.6968 8.9100 125.2855 59.4724 40.9974 174.0141 16 E 4.6279 8.4955 126.5110 54.5130 32.7096 174.3407 17 G 3.7975 7.2468 111.4922 45.9130 0.0000 172.1116 18 T 5.3165 8.3334 115.8651 61.7850 72.2308 174.0208 19 V 4.1764 8.9353 126.1583 61.9128 33.5106 175.0616 20 N 4.2432 9.9848 125.4097 54.3365 36.0097 175.4821 21 G 3.9368 8.6093 105.7163 45.4818 0.0000 173.4085 22 H 4.7246 8.3270 121.0060 54.8655 29.9976 173.3190 23 Y 4.9472 8.4602 128.9311 57.6272 40.2256 173.9283 24 F 4.8909 7.6153 119.6572 55.5671 42.1539 172.8315 25 K 4.9435 9.0799 120.1865 55.0695 35.7448 174.7461 26 C 5.6045 9.5595 123.6241 58.2602 32.9036 172.9132 27 T 5.1984 8.7493 110.4206 60.4393 72.1607 172.8014 28 G 4.5084 8.6898 107.7419 45.5022 0.0000 171.9828 29 K 4.9277 8.9013 121.4940 55.0582 36.2619 175.4560 30 G 3.6548 8.1350 112.5188 45.7425 0.0000 170.8120 31 E 5.0987 8.4857 118.8820 55.2024 33.6309 174.4996 32 G 4.4452 9.1965 111.0340 45.4106 0.0000 170.7767 33 N 5.4403 9.0875 118.8228 50.5102 39.6150 173.4790 34 P 4.0848 0.0000 0.0000 65.4140 31.5736 178.1149 35 F 4.4014 7.9262 114.4907 59.0936 39.3648 176.4924 36 E 4.1990 8.3259 118.1954 56.4358 29.7090 176.6146 37 G 3.8858 8.1021 107.0673 46.7297 0.0000 173.4108 38 T 4.9130 7.4619 108.2807 59.7845 72.1476 172.4399 39 Q 5.1126 8.4203 118.8379 55.9350 31.3979 172.6886 40 E 4.9961 9.1425 120.5949 55.2861 33.5054 173.6480 41 M 5.1300 8.5748 121.3818 53.7688 35.1218 173.5342 42 K 4.5521 8.9048 121.3714 54.7503 34.6454 174.7020 43 I 5.0462 8.3046 127.5512 59.5374 39.8083 174.5836 44 E 4.6438 9.3239 126.3470 54.3737 32.4635 175.2903 45 V 4.4488 8.5033 125.1638 62.6645 31.5688 175.2997 46 I 4.4524 8.9740 121.9828 61.2720 39.4418 175.7682 47 E 4.6438 7.9306 121.5902 55.6394 33.7783 176.5014 48 G 4.2248 8.8251 110.4726 46.6319 0.0000 173.5966 49 G 3.9844 7.6536 107.8699 43.2459 0.0000 172.2733 50 P 4.3410 0.0000 0.0000 61.7819 32.0642 176.4479 51 L 3.6155 8.1461 121.2682 54.6852 41.7609 175.1870 52 P 4.5733 0.0000 0.0000 62.5300 31.4907 175.2084 53 F 4.9191 6.6305 112.1691 54.7208 41.2084 173.9730 54 A 4.1414 8.6157 124.3643 52.0451 18.7605 178.4677 55 F 4.0869 9.1360 125.1947 61.7768 39.3517 176.7761 56 H 4.3284 8.9653 116.9478 58.0025 28.2265 176.8586 57 I 3.9071 7.5403 112.6032 62.5367 37.7896 177.0379 58 L 4.3116 7.8188 120.4494 54.7694 41.5579 178.2904 59 S 4.0400 7.4587 116.4994 61.8173 62.8759 176.0331 60 T 4.3448 7.7686 106.5060 62.2965 68.7904 174.8251 61 S 4.6268 7.8816 117.5963 58.6819 64.7386 173.8824 62 C 4.3639 8.0213 119.6093 58.3106 29.7228 173.3429 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 H 8.43 4.58 0.00 3.26 3.47 0.00 5.72 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 0 G 9.58 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.71 4.55 0.00 4.04 4.02 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 2 A 8.53 4.07 1.31 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 3 S 7.42 4.03 0.00 3.32 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.99 4.57 0.00 3.35 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.51 4.61 0.00 1.65 1.50 0.10 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.60 4.10 0.00 1.87 1.83 0.00 1.81 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.51 7.81 7 K 8.94 4.20 0.00 1.81 1.81 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.46 7.81 8 T 7.57 5.02 4.33 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 1.23 0.00 0.00 9 M 8.92 4.94 0.00 2.09 1.91 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 2.53 2.54 0.00 10 P 0.00 5.21 0.00 2.09 2.00 0.00 3.84 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 1.99 1.96 0.00 11 F 8.58 5.17 0.00 3.07 3.05 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 12 K 8.75 5.17 0.00 1.65 1.73 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.70 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.45 7.81 13 T 9.12 4.98 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 1.40 0.00 0.00 14 T 8.57 5.15 4.26 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 1.24 0.00 0.00 15 I 8.91 4.70 2.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.71 1.04 0.00 0.00 16 E 8.50 4.63 0.00 1.85 1.69 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 2.16 2.21 0.00 17 G 7.25 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 18 T 8.33 5.32 4.30 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 1.32 0.00 0.00 19 V 8.94 4.18 1.48 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 0.47 0.00 0.00 0.60 0.00 0.00 20 N 9.98 4.24 0.00 2.87 2.89 0.00 0.00 7.31 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 21 G 8.61 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.33 4.72 0.00 3.32 3.57 0.00 5.58 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 8.46 4.95 0.00 3.15 2.83 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 0.00 0.00 0.00 0.00 24 F 7.62 4.89 0.00 3.25 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 25 K 9.08 4.94 0.00 1.68 1.62 0.00 1.66 0.00 0.00 1.86 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.51 7.81 26 C 9.56 5.60 0.00 2.96 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 27 T 8.75 5.20 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 1.24 0.00 0.00 28 G 8.69 4.51 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 0.00 0.00 0.00 29 K 8.90 4.93 0.00 1.75 1.51 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.18 1.27 7.81 30 G 8.13 3.65 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 0.00 0.00 0.00 31 E 8.49 5.10 0.00 1.91 1.66 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 2.22 2.38 0.00 32 G 9.20 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.09 5.44 0.00 2.78 2.74 0.00 0.00 7.14 7.58 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 34 P 0.00 4.08 0.00 1.47 1.80 0.00 3.90 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 35 F 7.93 4.40 0.00 3.07 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 4.20 0.00 2.00 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 2.35 2.38 0.00 37 G 8.10 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.46 4.91 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 1.29 0.00 0.00 39 Q 8.42 5.11 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.74 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 40 E 9.14 5.00 0.00 2.06 1.77 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 2.20 2.28 0.00 41 M 8.57 5.13 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 42 K 8.90 4.55 0.00 1.77 1.63 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.28 1.32 7.81 43 I 8.30 5.05 1.76 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.76 1.10 0.00 0.00 44 E 9.32 4.64 0.00 1.83 1.81 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 2.18 2.19 0.00 45 V 8.50 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 0.95 0.00 0.00 0.93 0.00 0.00 46 I 8.97 4.45 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.85 0.99 0.00 0.00 47 E 7.93 4.64 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 2.37 2.38 0.00 48 G 8.83 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 49 G 7.65 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 50 P 0.00 4.34 0.00 2.12 2.01 0.00 3.78 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 1.95 1.96 0.00 51 L 8.15 3.62 0.00 1.19 0.45 0.62 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.57 0.00 2.16 2.05 0.00 3.19 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.52 0.00 53 F 6.63 4.92 0.00 3.01 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 54 A 8.62 4.14 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 55 F 9.14 4.09 0.00 3.09 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 56 H 8.97 4.33 0.00 3.27 3.40 0.00 6.14 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.54 3.91 1.77 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.38 0.89 0.00 0.00 58 L 7.82 4.31 0.00 0.69 1.42 0.79 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.46 4.04 0.00 3.95 3.93 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 60 T 7.77 4.34 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 1.19 0.00 0.00 61 S 7.88 4.63 0.00 3.95 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 62 C 8.02 4.36 0.00 3.25 3.01 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