NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 53 K 4.2596 8.3149 120.1339 56.3471 33.4932 172.9651 54 K 4.4734 8.2399 119.2144 55.8989 34.7151 172.0785 55 E 4.0259 8.7491 115.8184 57.1646 28.1975 175.6284 56 M 4.4511 7.8079 117.9032 56.5308 33.8992 176.0387 57 E 3.9742 8.1300 119.1417 59.2572 29.8364 178.4301 58 E 4.1457 8.1101 118.1832 59.1316 29.2531 179.1537 59 R 4.1073 7.8675 117.9406 59.1847 29.8463 178.8736 60 M 4.1181 7.4870 116.7882 58.3387 31.7436 178.5860 61 S 4.4353 7.9798 114.9792 61.2399 63.2025 176.1751 62 L 4.0217 7.6783 122.3314 57.8000 41.5568 178.5485 63 E 3.9994 7.7195 118.3991 59.0367 29.2663 178.2767 64 E 4.1444 7.9350 118.3240 59.5049 29.4182 179.2734 65 T 4.0051 7.8355 115.3669 66.3325 68.5607 176.8745 66 K 4.0367 8.0422 120.3618 59.1339 31.8734 178.9657 67 E 3.9383 7.9091 119.0190 59.0932 29.2768 178.5250 68 Q 4.0066 7.9334 118.5318 58.8243 29.7016 177.4331 69 I 3.9386 7.5245 121.0676 63.8020 37.0871 178.0008 70 L 4.0888 8.1334 121.5865 57.7589 41.9821 178.8303 71 K 4.0135 7.9138 119.9089 59.2594 32.0619 178.7952 72 L 4.0498 7.5956 118.4399 57.6660 41.5242 179.2297 73 E 4.0539 7.9426 118.4552 59.4306 29.4835 179.1585 74 E 4.0543 8.0768 118.1539 58.9281 29.2233 178.8935 75 K 4.0364 7.9644 119.6664 58.9828 31.7300 178.6226 76 L 4.0526 8.4324 121.2831 57.7578 41.9786 178.7691 77 L 4.0930 7.9753 118.7300 57.4021 41.4358 179.1562 78 A 4.0764 7.9565 120.4836 54.8125 18.0280 179.7343 79 L 3.9697 7.6479 117.2866 58.1511 41.6554 179.7020 80 Q 4.1492 7.8391 116.9203 58.8576 28.3686 178.5770 81 E 4.0567 7.8740 118.7144 59.0901 29.8129 178.9011 82 E 4.1348 7.8932 119.0454 59.3705 29.4529 179.2792 83 K 4.0700 7.7946 118.2557 59.6961 32.0925 178.3182 84 H 4.1960 8.1409 118.3906 59.0792 29.5714 177.0393 85 Q 4.0734 8.0697 121.2256 59.0505 28.8467 178.1443 86 L 4.0330 7.8498 120.0860 57.6479 40.0486 179.3634 87 F 3.8500 8.1240 118.1128 60.4399 38.5681 177.6086 88 L 4.3453 7.7703 117.9345 57.2362 41.4549 178.6081 89 Q 4.4146 7.2114 115.4537 56.3627 29.6828 175.9382 90 L 4.1288 8.1471 125.9999 55.4542 42.2189 176.2552 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 53 K 8.31 4.26 0.00 1.76 1.87 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.47 7.81 54 K 8.24 4.47 0.00 1.79 1.74 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.52 7.81 55 E 8.75 4.03 0.00 2.08 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 2.22 2.23 0.00 56 M 7.81 4.45 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 57 E 8.13 3.97 0.00 2.07 1.93 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 2.38 2.40 0.00 58 E 8.11 4.15 0.00 2.05 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 2.40 2.39 0.00 59 R 7.87 4.11 0.00 2.06 1.97 0.00 3.29 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 60 M 7.49 4.12 0.00 2.04 2.29 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 61 S 7.98 4.44 0.00 3.98 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 62 L 7.68 4.02 0.00 1.74 1.77 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 63 E 7.72 4.00 0.00 2.15 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 2.32 2.35 0.00 64 E 7.93 4.14 0.00 2.24 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 2.32 2.34 0.00 65 T 7.84 4.01 4.38 0.00 0.00 0.00 0.00 0.00 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 66 K 8.04 4.04 0.00 1.97 1.85 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.58 7.81 67 E 7.91 3.94 0.00 2.07 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 2.30 2.46 0.00 68 Q 7.93 4.01 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 69 I 7.52 3.94 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.89 0.91 0.00 0.00 70 L 8.13 4.09 0.00 1.94 1.65 0.92 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 71 K 7.91 4.01 0.00 1.96 1.93 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.52 7.81 72 L 7.60 4.05 0.00 2.06 1.70 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 E 7.94 4.05 0.00 2.19 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 2.33 2.49 0.00 74 E 8.08 4.05 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 75 K 7.96 4.04 0.00 2.01 1.79 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 76 L 8.43 4.05 0.00 1.83 1.64 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.98 4.09 0.00 1.90 1.69 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.96 4.08 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.65 3.97 0.00 1.94 1.74 0.93 0.95 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 80 Q 7.84 4.15 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 81 E 7.87 4.06 0.00 2.18 2.01 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 2.31 2.47 0.00 82 E 7.89 4.13 0.00 2.15 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 2.34 2.47 0.00 83 K 7.79 4.07 0.00 1.93 2.01 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.62 1.57 7.81 84 H 8.14 4.20 0.00 3.37 3.49 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.07 4.07 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 86 L 7.85 4.03 0.00 1.94 1.67 0.93 1.40 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 87 F 8.12 3.85 0.00 3.24 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 88 L 7.77 4.35 0.00 1.85 1.78 0.96 0.98 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 89 Q 7.21 4.41 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 90 L 8.15 4.13 0.00 1.49 1.31 0.76 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00