NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 T 4.2088 8.0327 115.2301 61.5434 69.5283 174.6771 10 V 3.4658 7.4068 119.9388 64.7999 32.0513 175.1637 11 P 4.1043 0.0000 0.0000 65.7583 31.4544 178.8483 12 K 3.8986 7.8479 122.1946 59.7387 31.6829 181.4782 13 L 4.1648 7.2682 121.8536 58.1316 42.0154 178.6532 14 Y 4.2669 7.9466 116.6423 61.1503 37.8172 178.7564 15 R 3.7496 8.2696 119.2015 59.2908 30.2460 178.6994 16 S 4.0367 8.2778 113.2062 61.7202 62.2466 176.6234 17 V 3.6284 8.3488 120.8237 65.9573 31.2460 177.9749 18 I 3.1589 7.9317 119.9224 64.1419 36.8097 178.1019 19 E 3.8838 8.4576 119.6032 59.5993 29.3171 179.0410 20 D 4.3655 8.0751 118.6108 57.4887 40.9428 179.2547 21 V 3.6497 8.2297 118.8463 66.0734 31.0872 178.0116 22 I 3.6808 8.2065 119.8838 64.5844 36.7677 178.1364 23 N 4.3537 8.3006 116.1529 56.5017 38.5235 176.8915 24 D 4.5528 8.4626 118.3492 55.9426 41.2167 177.8852 25 V 4.2958 7.5148 111.6178 60.9886 32.4561 177.3545 26 R 3.7645 7.4607 118.7579 59.9339 29.8367 177.8636 27 D 4.3983 8.1519 117.6657 57.4646 40.8164 178.8685 28 I 3.7800 7.7205 119.8520 64.3364 37.1346 178.2541 29 F 4.0015 8.8256 118.8947 60.5554 38.7906 177.7199 30 L 4.0559 8.3776 118.7778 58.0861 41.2602 179.4355 31 D 4.4356 8.6443 117.6622 57.0143 40.7953 177.8218 32 D 4.6195 7.9020 117.6499 54.4283 41.0872 177.2560 33 G 3.8337 7.9430 107.4823 45.6777 0.0000 173.1234 34 V 4.0532 7.7505 119.5755 60.7381 32.6322 175.4953 35 D 4.4625 8.6336 126.5086 54.3393 41.8930 176.6491 36 E 4.1029 8.9167 125.7668 59.1010 29.5326 179.1110 37 Q 4.0346 9.5489 119.6459 59.0303 28.6695 178.5652 38 V 3.6780 7.9965 119.3480 65.8374 31.5488 177.6872 39 L 3.6234 7.9573 119.5531 58.5936 41.9139 178.8730 40 M 4.1093 7.9160 117.8901 58.1434 31.7247 178.4383 41 E 3.9640 8.2600 119.8031 58.9889 29.8307 178.2663 42 L 4.0315 8.1771 120.5976 58.2940 42.1494 178.6648 43 K 4.0398 8.1323 119.2362 60.0736 32.0508 178.8083 44 T 3.8630 8.0730 115.5677 66.6199 68.4442 176.4979 45 L 4.0290 8.6360 121.3343 57.6578 41.5678 179.4358 46 W 4.3919 8.7747 128.2792 60.8191 30.4940 177.8214 47 E 3.8470 8.4718 117.4035 59.5537 29.0236 178.9293 48 N 4.5360 8.4771 116.5333 56.1188 38.3620 177.7032 49 K 4.0668 8.0943 119.3313 59.1752 32.1352 179.0168 50 L 4.2114 7.5853 118.8793 58.0073 41.6642 177.0821 51 M 4.2707 7.5767 121.7184 55.6035 31.9018 176.0613 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 9 T 8.03 4.21 4.20 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 1.16 0.00 0.00 10 V 7.41 3.47 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.80 0.00 0.00 11 P 0.00 4.10 0.00 2.11 2.01 0.00 3.53 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 12 K 7.85 3.90 0.00 1.76 1.82 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.07 7.81 13 L 7.27 4.16 0.00 1.66 1.80 0.96 1.14 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 14 Y 7.95 4.27 0.00 3.10 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.27 3.75 0.00 1.91 1.92 0.00 3.25 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 16 S 8.28 4.04 0.00 3.96 4.11 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 0.00 0.00 0.00 0.00 17 V 8.35 3.63 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 1.15 0.00 0.00 1.03 0.00 0.00 18 I 7.93 3.16 1.60 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.15 0.48 0.00 0.00 19 E 8.46 3.88 0.00 2.05 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 0.00 2.51 2.46 0.00 20 D 8.08 4.37 0.00 2.86 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 21 V 8.23 3.65 2.43 0.00 0.00 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 0.00 0.00 1.16 0.00 0.00 22 I 8.21 3.68 2.02 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 1.91 1.24 0.85 0.00 0.00 23 N 8.30 4.35 0.00 2.85 2.88 0.00 0.00 7.16 7.83 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 24 D 8.46 4.55 0.00 2.75 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 25 V 7.51 4.30 2.26 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 0.88 0.00 0.00 0.82 0.00 0.00 26 R 7.46 3.76 0.00 1.85 2.01 0.00 3.08 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 27 D 8.15 4.40 0.00 2.76 2.74 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 0.00 0.00 0.00 28 I 7.72 3.78 2.20 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.84 0.95 0.00 0.00 29 F 8.83 4.00 0.00 3.17 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 30 L 8.38 4.06 0.00 1.89 1.76 0.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.64 4.44 0.00 2.75 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 32 D 7.90 4.62 0.00 2.85 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.94 3.83 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 0.00 0.00 0.00 34 V 7.75 4.05 2.14 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 0.82 0.00 0.00 0.74 0.00 0.00 35 D 8.63 4.46 0.00 2.75 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 36 E 8.92 4.10 0.00 2.10 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 2.38 2.39 0.00 37 Q 9.55 4.03 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 38 V 8.00 3.68 2.41 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 1.22 0.00 0.00 1.04 0.00 0.00 39 L 7.96 3.62 0.00 1.36 1.72 -0.07 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 40 M 7.92 4.11 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.89 0.00 41 E 8.26 3.96 0.00 2.23 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 0.00 2.34 2.34 0.00 42 L 8.18 4.03 0.00 1.90 1.97 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.13 4.04 0.00 1.91 1.98 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.48 7.81 44 T 8.07 3.86 4.42 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 1.24 0.00 0.00 45 L 8.64 4.03 0.00 1.91 1.79 0.96 1.06 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 46 W 8.77 4.39 0.00 3.44 3.30 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 47 E 8.47 3.85 0.00 1.92 1.94 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 2.12 2.57 0.00 48 N 8.48 4.54 0.00 2.78 2.89 0.00 0.00 7.03 6.79 0.00 0.00 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 8.09 4.07 0.00 2.11 1.97 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.53 7.81 50 L 7.59 4.21 0.00 1.83 1.79 0.81 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 51 M 7.58 4.27 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.49 0.00