NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3100 8.1133 120.8598 56.6539 32.2423 177.6309 2 M 3.9036 7.9336 117.3736 57.1675 31.8391 176.7213 3 K 3.9822 8.2829 119.6170 59.7880 32.6936 178.0446 4 Q 3.9370 8.0226 119.0563 59.1277 28.9620 178.0337 5 I 3.6932 7.7183 120.7914 64.5549 37.1931 178.2140 6 E 3.9761 8.5405 119.7289 59.6512 29.3144 179.2930 7 D 4.3924 8.4173 119.1249 57.0063 40.7665 178.7335 8 K 3.9589 8.1733 120.3922 59.4233 32.1882 178.8542 9 I 3.6769 8.1055 120.5261 64.4638 37.0520 178.0576 10 E 3.9511 8.1574 119.2951 59.4971 29.3261 179.1544 11 E 3.9344 8.1105 118.9969 59.2860 29.6325 178.8834 12 I 3.7032 7.9951 120.0371 64.5229 37.1270 178.2414 13 E 3.9438 8.6076 119.8093 59.3638 29.2531 179.4324 14 S 4.0603 8.1323 113.0952 61.4416 62.4527 176.4409 15 K 4.0058 8.1710 121.2034 59.4180 31.6661 179.1665 16 Q 3.9292 8.4206 120.2699 58.9809 28.8879 178.2086 17 K 4.0821 8.3246 120.9043 59.4457 32.2072 178.9283 18 K 3.9509 8.1247 118.8035 59.4338 31.8616 179.3578 19 I 3.6924 7.9751 120.1562 64.4816 37.0383 178.3068 20 E 3.9497 8.3861 119.5260 59.5640 29.2694 179.2498 21 N 4.3346 8.4197 116.6849 56.2251 38.5270 177.1285 22 E 3.9364 8.3925 120.8430 59.2747 29.6465 178.8868 23 I 3.6880 8.0782 119.9286 64.3002 37.1591 178.2417 24 A 3.9622 8.1809 121.6505 55.1306 18.1397 179.9803 25 R 3.8423 7.9940 116.5505 59.4278 30.1893 179.1447 26 I 3.6579 8.0556 119.9953 64.5054 37.0443 178.6497 27 K 3.9517 8.2526 119.2715 59.3026 31.8801 179.6223 28 K 3.8342 8.0318 118.7575 59.3119 31.9238 179.2152 29 L 3.8967 8.0233 120.6907 57.9814 41.9470 178.6691 30 L 3.8990 8.2274 122.0698 57.4884 41.9918 178.5294 31 Q 3.4465 8.0020 119.6198 59.1497 28.7466 178.5884 32 L 4.0079 7.6508 119.9547 57.9343 41.3967 179.6637 33 T 3.8692 8.0447 109.9721 64.6486 68.6368 176.7879 34 V 3.6344 7.8610 121.2968 65.5943 31.4531 177.9893 35 W 4.6305 8.1319 118.7466 59.8138 28.8976 178.7076 36 G 3.6875 8.5614 105.8490 47.9365 0.0000 175.8144 37 I 3.7516 8.0923 122.7944 64.0940 37.1656 178.7689 38 K 4.3164 8.3822 120.9086 58.9987 31.9377 179.4762 39 Q 4.0340 8.4731 118.7165 58.9290 28.4867 178.8173 40 L 4.0350 8.0029 120.0610 57.8639 41.1352 179.4473 41 Q 4.0058 8.5066 118.1987 59.0439 28.3629 178.9312 42 A 4.0794 8.2257 121.7206 55.0389 18.1551 179.8920 43 R 3.9176 7.7138 116.0607 58.8048 30.2519 178.3000 44 I 4.2140 7.1883 109.8127 60.9321 38.1709 176.0487 45 L 4.2403 7.4854 127.4667 55.7182 42.0842 175.9622 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 R 8.11 4.31 0.00 1.86 1.99 0.00 3.14 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 2 M 7.93 3.90 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 3 K 8.28 3.98 0.00 1.78 1.82 0.00 1.74 0.00 0.00 2.10 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.46 7.81 4 Q 8.02 3.94 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 5 I 7.72 3.69 2.04 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 1.52 0.63 0.91 0.00 0.00 6 E 8.54 3.98 0.00 2.13 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 2.45 0.00 7 D 8.42 4.39 0.00 2.81 2.71 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 K 8.17 3.96 0.00 1.98 1.91 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.52 7.81 9 I 8.11 3.68 2.06 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 1.52 0.50 0.94 0.00 0.00 10 E 8.16 3.95 0.00 2.23 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 2.33 0.00 11 E 8.11 3.93 0.00 2.11 2.09 0.00 0.00 0.00 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 2.39 0.00 12 I 8.00 3.70 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 1.52 0.65 0.91 0.00 0.00 13 E 8.61 3.94 0.00 2.11 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 2.54 0.00 14 S 8.13 4.06 0.00 3.96 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 4.01 0.00 2.00 1.84 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.81 7.81 16 Q 8.42 3.93 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 17 K 8.32 4.08 0.00 1.89 1.96 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.52 7.81 18 K 8.12 3.95 0.00 2.01 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.69 7.81 19 I 7.98 3.69 2.02 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 1.52 0.73 0.90 0.00 0.00 20 E 8.39 3.95 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 2.32 2.53 0.00 21 N 8.42 4.33 0.00 2.85 2.86 0.00 0.00 6.68 8.06 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 22 E 8.39 3.94 0.00 2.07 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 2.30 2.38 0.00 23 I 8.08 3.69 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.60 0.89 0.00 0.00 24 A 8.18 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 3.84 0.00 2.18 1.97 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 26 I 8.06 3.66 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 0.88 0.00 0.00 27 K 8.25 3.95 0.00 1.89 1.79 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.65 7.81 28 K 8.03 3.83 0.00 1.93 1.81 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.53 7.81 29 L 8.02 3.90 0.00 1.72 1.62 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.23 3.90 0.00 1.78 1.76 0.87 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.00 3.45 0.00 1.73 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 32 L 7.65 4.01 0.00 1.88 1.74 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.04 3.87 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 1.25 0.00 0.00 34 V 7.86 3.63 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 1.11 0.00 0.00 0.91 0.00 0.00 35 W 8.13 4.63 0.00 3.67 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 36 G 8.56 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.09 3.75 2.04 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 1.54 0.82 0.93 0.00 0.00 38 K 8.38 4.32 0.00 2.05 1.93 0.00 1.88 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.57 7.81 39 Q 8.47 4.03 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 40 L 8.00 4.03 0.00 1.88 1.73 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.51 4.01 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 42 A 8.23 4.08 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 43 R 7.71 3.92 0.00 1.99 2.01 0.00 3.16 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 44 I 7.19 4.21 1.87 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 1.69 0.58 0.96 0.00 0.00 45 L 7.49 4.24 0.00 1.78 1.79 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00