NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.4689 8.3644 120.3180 53.6179 40.7703 171.3713 2 V 3.1325 8.2744 125.4358 61.8355 32.1936 169.6505 3 N 5.1432 8.6477 122.6988 51.6591 42.5058 172.8665 4 E 4.4795 8.7801 117.5272 57.3202 31.3410 176.5643 5 C 4.5954 8.0093 119.0559 55.0826 41.9670 171.9323 6 I 4.0907 7.5261 122.5873 61.4528 39.0880 176.8860 7 S 4.4733 7.4885 114.9051 57.6755 61.7505 174.3287 8 N 4.0124 7.9456 120.2431 52.9122 36.6936 171.0407 9 P 3.9098 0.0000 0.0000 65.0932 31.6859 178.6321 10 C 4.6787 7.6567 115.3213 57.3288 40.5106 173.0833 11 Q 4.6818 9.0225 120.1497 55.6290 29.1731 176.8538 12 N 4.8798 8.0754 110.8984 53.7218 40.9594 173.8446 13 D 4.2566 8.1842 114.7062 55.3399 38.8776 173.3004 14 A 4.5612 7.7539 118.3837 51.0176 21.2884 177.7200 15 T 4.3313 8.1070 116.2701 62.9301 70.0810 173.4511 16 C 5.2679 8.7638 126.4356 55.5458 45.1268 172.3883 17 L 4.9672 8.5951 126.2001 53.2666 44.8157 175.0585 18 D 4.9927 8.6142 118.3026 54.0084 42.6569 176.2257 19 Q 4.3883 8.2464 119.3298 54.7140 33.0424 174.5786 20 I 3.9787 8.2406 112.4795 60.5795 36.6799 175.4405 21 G 4.1210 8.7550 113.4567 46.1572 0.0000 170.8232 22 E 4.6130 7.6242 117.5094 54.9521 33.7593 174.0406 23 F 4.9554 7.6305 114.1792 55.8331 40.5537 175.8336 24 Q 4.5020 8.7342 121.1789 54.5304 29.9564 173.0988 25 C 4.8751 8.8570 120.4827 55.7045 37.1341 173.6602 26 I 4.2043 8.8568 127.6572 60.1412 36.9380 175.4443 27 C 4.6489 8.4800 124.8171 56.2381 41.5663 172.9963 28 M 4.0181 7.7523 120.2750 54.1288 32.0128 175.0182 29 P 4.3654 0.0000 0.0000 66.3274 30.4274 175.9711 30 G 4.1384 9.0414 113.7891 46.0064 0.0000 171.3544 31 Y 4.5660 7.8567 117.7250 56.2636 40.2833 173.6276 32 E 4.5986 8.3667 118.5631 55.7259 33.6995 175.3126 33 G 4.2387 8.8029 104.9766 45.7970 0.0000 173.7863 34 V 3.9023 8.1595 117.8672 64.9808 32.1140 176.6537 35 Y 4.8500 7.8704 115.9087 57.9520 38.2375 175.0154 36 C 4.5822 8.3770 116.8505 57.5508 37.1060 171.1425 37 E 4.9742 8.6964 119.2275 57.2372 36.2445 175.1072 38 I 4.0228 7.7790 122.3811 61.4602 37.3390 175.4684 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 D 8.36 4.47 0.00 2.81 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 2 V 8.27 3.13 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 0.83 0.00 0.00 0.94 0.00 0.00 3 N 8.65 5.14 0.00 2.74 2.77 0.00 0.00 6.76 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 4 E 8.78 4.48 0.00 2.08 2.24 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 2.36 2.58 0.00 5 C 8.01 4.60 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 6 I 7.53 4.09 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.99 0.90 0.00 0.00 7 S 7.49 4.47 0.00 3.76 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 8 N 7.95 4.01 0.00 2.81 2.74 0.00 0.00 7.27 7.66 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 9 P 0.00 3.91 0.00 1.79 1.76 0.00 3.78 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 10 C 7.66 4.68 0.00 3.05 3.10 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 11 Q 9.02 4.68 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.20 0.00 0.00 0.00 0.00 0.00 2.17 2.38 0.00 12 N 8.08 4.88 0.00 2.84 2.77 0.00 0.00 7.51 8.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.18 4.26 0.00 2.80 2.73 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 0.00 0.00 0.00 0.00 14 A 7.75 4.56 1.25 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 15 T 8.11 4.33 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 1.22 0.00 0.00 16 C 8.76 5.27 0.00 3.00 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 17 L 8.60 4.97 0.00 1.55 1.59 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.61 4.99 0.00 2.56 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.25 4.39 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.01 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 20 I 8.24 3.98 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.81 0.90 0.00 0.00 21 G 8.76 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.62 4.61 0.00 2.03 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.35 0.00 23 F 7.63 4.96 0.00 3.09 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 24 Q 8.73 4.50 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.04 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 25 C 8.86 4.88 0.00 3.22 3.20 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 26 I 8.86 4.20 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.08 0.91 0.00 0.00 27 C 8.48 4.65 0.00 2.90 3.08 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 28 M 7.75 4.02 0.00 1.37 0.57 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 2.23 2.30 0.00 29 P 0.00 4.37 0.00 2.20 2.11 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 30 G 9.04 4.14 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 0.00 0.00 0.00 31 Y 7.86 4.57 0.00 3.03 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 32 E 8.37 4.60 0.00 1.85 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 0.00 2.31 2.28 0.00 33 G 8.80 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 0.00 0.00 0.00 0.00 34 V 8.16 3.90 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 0.71 0.00 0.00 0.91 0.00 0.00 35 Y 7.87 4.85 0.00 3.05 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.38 4.58 0.00 3.16 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 37 E 8.70 4.97 0.00 1.99 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 2.26 2.36 0.00 38 I 7.78 4.02 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.98 0.90 0.00 0.00