NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3026 8.4449 120.2248 56.4816 31.1725 175.2845 2 T 4.3005 8.0115 115.1556 61.4140 71.1959 172.2186 3 S 4.7775 8.9001 122.8063 56.8756 67.6648 172.7819 4 Y 4.7900 8.1799 118.5611 57.0010 41.6152 174.9089 5 T 4.7963 8.2774 119.2416 62.1539 72.7867 173.3626 6 L 4.3813 8.2523 123.9165 54.4621 44.7696 174.3157 7 N 5.1061 8.4191 123.0357 51.8448 41.4110 173.4685 8 E 4.6486 8.0709 118.1609 55.2293 32.4642 174.7618 9 V 3.8753 8.2769 125.1760 62.2597 32.2294 175.8896 10 V 4.3016 8.0897 126.2348 60.3147 32.5207 172.9783 11 P 4.5959 0.0000 0.0000 61.7469 29.8395 176.9310 12 L 4.3779 8.4671 127.6493 58.3398 41.4129 178.6356 13 K 3.9991 8.0580 118.0065 58.7795 32.1722 177.6048 14 E 4.0648 8.0389 117.8492 57.5409 29.8557 177.4840 15 F 4.7089 7.7015 115.9677 57.1817 40.2732 175.9676 16 V 4.4646 7.0177 116.7840 59.7845 33.4622 173.3955 17 P 4.5572 0.0000 0.0000 62.4205 32.0445 176.3462 18 E 4.0050 8.9477 118.3337 58.8868 29.4482 177.6685 19 W 4.7339 8.0975 116.6515 54.9925 30.8377 175.6084 20 V 4.6845 8.2863 114.6700 59.7506 35.2463 174.4959 21 R 4.7662 8.3207 118.4160 54.4802 33.4935 174.8502 22 I 4.5844 8.2026 112.3056 58.6818 40.7595 175.2032 23 G 3.6430 6.9980 106.3094 45.9911 0.0000 171.8628 24 F 4.8328 8.1840 116.8392 55.5484 42.2197 174.5186 25 S 4.7275 8.2986 115.4405 57.0269 66.0152 172.7920 26 A 4.6124 8.0891 122.4595 51.6201 21.8062 175.4934 27 T 4.6584 7.7340 108.3707 60.6059 71.5683 172.7464 28 T 4.9511 8.2158 111.6603 60.1386 73.4890 175.0361 29 G 4.2390 8.7915 112.4352 45.9119 0.0000 174.9713 30 A 4.3779 9.1933 128.5297 52.4180 19.4372 177.5869 31 E 4.9805 7.9027 114.7905 54.4250 33.0982 174.4882 32 F 5.2291 7.6070 113.5332 56.0500 40.8931 173.2511 33 A 4.4116 8.0927 120.8771 51.2269 21.4225 176.1243 34 A 4.1868 8.5037 123.6654 52.2559 19.1248 177.4966 35 H 4.6976 8.6576 118.4344 54.0739 30.8300 172.7628 36 E 4.6593 8.5228 123.1167 54.1311 32.7085 175.7885 37 V 4.1640 8.0566 121.2475 61.1194 33.3254 175.4659 38 L 4.3471 8.3242 126.7000 56.2189 42.3682 176.3257 39 S 4.7074 7.5555 110.0088 57.7247 65.0503 174.3809 40 W 5.4843 8.6134 129.9273 56.3736 33.4574 173.1717 41 Y 4.8942 8.9351 125.3445 55.7843 41.3646 174.0138 42 F 4.3490 7.7322 126.8053 56.5526 42.6671 172.9673 43 H 4.6371 7.3409 125.2831 54.1900 32.6819 172.5083 44 S 4.3397 7.8416 119.4582 56.3148 66.0191 172.7592 45 E 4.5709 8.2363 121.1414 54.2884 32.5863 174.3460 46 L 4.5670 8.2132 125.3511 52.9018 44.7248 176.0230 47 A 4.1557 8.6328 127.6027 52.5200 18.3500 176.7845 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 E 8.44 4.30 0.00 1.96 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 2.21 2.28 0.00 2 T 8.01 4.30 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 1.14 0.00 0.00 3 S 8.90 4.78 0.00 3.67 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 4 Y 8.18 4.79 0.00 2.93 2.80 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 5 T 8.28 4.80 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 6 L 8.25 4.38 0.00 1.57 1.53 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.42 5.11 0.00 2.71 2.70 0.00 0.00 6.89 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 8 E 8.07 4.65 0.00 1.86 1.76 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 2.18 2.33 0.00 9 V 8.28 3.88 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 0.85 0.00 0.00 0.95 0.00 0.00 10 V 8.09 4.30 2.12 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 0.94 0.00 0.00 0.92 0.00 0.00 11 P 0.00 4.60 0.00 2.20 2.22 0.00 4.06 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 2.12 2.03 0.00 12 L 8.47 4.38 0.00 1.80 1.83 1.05 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.06 4.00 0.00 1.71 1.77 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.48 7.81 14 E 8.04 4.06 0.00 1.16 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 2.00 2.14 0.00 15 F 7.70 4.71 0.00 3.06 3.02 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 16 V 7.02 4.46 2.31 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 0.85 0.00 0.00 0.99 0.00 0.00 17 P 0.00 4.56 0.00 2.44 2.10 0.00 3.88 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 18 E 8.95 4.01 0.00 2.07 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 0.00 2.25 2.33 0.00 19 W 8.10 4.73 0.00 3.21 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 20 V 8.29 4.68 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 0.82 0.00 0.00 0.96 0.00 0.00 21 R 8.32 4.77 0.00 1.75 1.78 0.00 3.16 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 22 I 8.20 4.58 1.78 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.69 0.80 0.00 0.00 23 G 7.00 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 24 F 8.18 4.83 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 25 S 8.30 4.73 0.00 3.89 3.76 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 26 A 8.09 4.61 1.06 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 27 T 7.73 4.66 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 1.19 0.00 0.00 28 T 8.22 4.95 4.46 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 0.00 0.00 1.38 0.00 0.00 29 G 8.79 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 30 A 9.19 4.38 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 31 E 7.90 4.98 0.00 1.99 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 32 F 7.61 5.23 0.00 3.09 2.92 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 33 A 8.09 4.41 1.10 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 0.00 0.00 34 A 8.50 4.19 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 35 H 8.66 4.70 0.00 3.04 3.18 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.52 4.66 0.00 1.86 1.76 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 2.17 2.22 0.00 37 V 8.06 4.16 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 0.29 0.00 0.00 0.21 0.00 0.00 38 L 8.32 4.35 0.00 1.64 1.71 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.56 4.71 0.00 4.05 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 40 W 8.61 5.48 0.00 3.34 3.06 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 41 Y 8.94 4.89 0.00 3.00 2.94 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 42 F 7.73 4.35 0.00 2.62 2.33 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 43 H 7.34 4.64 0.00 3.04 2.95 0.00 5.73 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.84 4.34 0.00 3.80 3.36 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 45 E 8.24 4.57 0.00 1.78 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 2.14 2.25 0.00 46 L 8.21 4.57 0.00 1.46 1.39 0.82 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.63 4.16 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