NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9272 8.3549 109.7366 45.6219 0.0000 172.0331 2 S 4.3625 8.1611 121.2788 57.7048 64.1574 171.9308 3 S 4.3675 8.7706 119.3471 60.2417 66.5853 174.7928 4 G 3.8447 8.2414 105.7270 44.6205 0.0000 171.6454 5 S 4.5612 8.4657 111.3773 59.6381 64.6702 175.1702 6 S 4.3271 7.9871 114.9017 58.1398 63.8604 173.7042 7 G 3.8014 7.9917 114.0392 44.5631 0.0000 171.8722 8 A 4.2474 8.2911 121.9252 51.0383 22.1099 175.7103 9 Q 4.2099 8.5979 122.1621 56.7296 28.9360 175.8013 10 E 4.8673 8.6339 123.6280 56.1014 31.8359 175.3056 11 Y 4.7787 9.1519 119.5908 56.3749 41.3638 174.2732 12 R 4.7951 9.1076 125.3954 54.5556 31.4805 175.3948 13 A 4.3974 8.2123 129.1720 52.7900 19.2484 177.6527 14 L 4.0779 8.5419 117.7321 55.5757 43.9205 176.9688 15 Y 4.9503 7.4979 113.1622 55.8304 42.1011 174.9159 16 D 4.7390 9.1251 123.0240 54.9449 42.2525 174.5953 17 Y 4.7936 8.7407 126.3768 56.1435 41.8140 174.1562 18 T 4.4289 7.9196 123.3086 61.5562 69.5821 174.6073 19 A 3.8458 8.5263 131.0826 52.0270 18.3415 177.0950 20 Q 4.0618 8.7341 122.3025 59.3790 29.1031 177.2986 21 N 4.8499 7.7966 114.4257 51.1285 40.0901 174.0083 22 P 4.5306 0.0000 0.0000 64.2098 31.6739 176.9324 23 D 4.4832 7.7017 119.6273 56.8644 41.3448 177.1838 24 E 4.4458 7.8889 116.1934 56.1805 30.2915 175.6165 25 L 4.8505 7.5944 120.6288 53.1122 44.2001 176.2308 26 D 5.2913 8.5669 122.5081 53.5643 41.8444 176.5004 27 L 4.6158 8.6025 123.6927 54.0687 44.8615 175.4198 28 S 4.8212 8.5880 109.1292 57.4698 65.6466 173.8733 29 A 4.3884 8.4748 129.2291 54.5178 17.7772 175.7235 30 G 4.0855 9.5282 113.1430 46.5659 0.0000 173.9818 31 D 4.4386 8.6467 120.0525 55.1019 42.0294 176.2464 32 I 4.5905 8.3687 123.6048 60.1686 38.4334 174.8106 33 L 5.0223 8.7735 126.0596 52.9017 46.7418 174.7998 34 E 5.2497 8.4111 119.0608 53.5444 32.9664 174.7455 35 V 4.4137 8.5073 126.1863 62.2428 31.7274 175.5331 36 I 4.0303 8.9429 130.3494 63.8219 37.4434 176.2027 37 L 4.6954 7.6435 121.6231 53.2856 46.2586 174.3944 38 E 3.3503 8.3375 121.9510 53.9017 31.2107 176.2119 39 G 3.9760 7.7232 113.2862 44.5147 0.0000 173.5225 40 E 4.1666 8.6338 120.3272 58.1353 30.3996 177.4735 41 D 4.4836 8.6519 118.5860 55.2871 42.0730 176.3765 42 G 3.9549 8.1186 115.6515 46.0241 0.0000 171.6997 43 W 4.7073 7.6929 120.3214 56.9202 29.2165 176.0845 44 W 4.8244 9.6657 126.1506 55.9364 31.1455 175.9146 45 T 5.2553 8.3342 119.9748 62.4593 69.6683 174.2975 46 V 5.5810 8.2926 117.7637 58.4069 36.3969 174.3537 47 E 5.0143 8.6741 122.6883 54.6622 33.5980 175.2771 48 R 4.4446 9.0691 125.2808 55.8089 32.1687 174.4698 49 N 4.4336 9.7645 125.7537 54.6628 37.2295 174.2795 50 G 4.2042 8.5071 106.6598 45.4254 0.0000 174.9818 51 Q 4.0919 7.7313 118.3052 55.6965 29.3251 174.8737 52 R 4.7356 8.1150 121.8280 55.0831 32.9759 174.9229 53 G 3.8277 7.8392 109.6323 45.5956 0.0000 171.2359 54 F 5.4304 8.3267 117.1043 55.9830 42.6219 174.9011 55 V 5.2304 9.2044 116.3084 58.7971 36.7018 173.2157 56 P 4.9267 0.0000 0.0000 61.8361 32.0960 177.6183 57 G 2.4958 8.1886 111.2985 48.2314 0.0000 175.3750 58 S 4.0385 7.7373 114.9387 61.3918 62.8342 174.4380 59 Y 4.6657 7.8338 116.5717 57.9336 38.0663 174.9389 60 L 5.0490 8.1528 118.3223 53.3962 46.5664 176.0967 61 E 4.6029 8.5279 121.0472 54.9421 33.3448 173.8688 62 K 3.2031 8.4994 129.1730 55.7261 32.8903 176.0656 63 L 4.2154 7.7830 128.8180 54.4443 41.9761 176.7171 64 S 4.6194 8.4241 120.4724 57.4907 65.3801 174.7301 65 G 4.2520 8.6918 114.4147 45.7636 0.0000 172.3280 66 P 4.5373 0.0000 0.0000 64.2996 32.0180 177.0673 67 S 4.6039 7.0551 111.4052 57.4787 65.6502 172.6742 68 S 3.7429 8.6516 117.1381 59.1159 60.0374 172.7189 69 G 3.7527 7.9248 113.0354 46.4588 0.0000 173.7996 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 G 8.35 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.16 4.36 0.00 3.96 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.77 4.37 0.00 3.79 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 4 G 8.24 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.47 4.56 0.00 3.97 3.97 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 0.00 0.00 0.00 6 S 7.99 4.33 0.00 4.00 3.92 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 7 G 7.99 3.80 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 0.00 0.00 0.00 8 A 8.29 4.25 1.33 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 0.00 0.00 9 Q 8.60 4.21 0.00 2.37 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.02 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 10 E 8.63 4.87 0.00 1.90 1.90 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 2.60 2.31 0.00 11 Y 9.15 4.78 0.00 2.94 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 9.11 4.80 0.00 1.83 1.78 0.00 3.10 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 13 A 8.21 4.40 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 14 L 8.54 4.08 0.00 1.34 0.57 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 7.50 4.95 0.00 2.86 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 9.13 4.74 0.00 2.77 2.70 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 0.00 0.00 0.00 0.00 17 Y 8.74 4.79 0.00 2.96 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.92 4.43 4.03 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 0.00 0.00 1.13 0.00 0.00 19 A 8.53 3.85 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 20 Q 8.73 4.06 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 21 N 7.80 4.85 0.00 2.90 2.70 0.00 0.00 7.16 8.08 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 22 P 0.00 4.53 0.00 2.16 2.15 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 23 D 7.70 4.48 0.00 2.63 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.89 4.45 0.00 2.01 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 0.00 2.32 2.42 0.00 25 L 7.59 4.85 0.00 1.71 1.60 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.57 5.29 0.00 2.56 2.70 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 0.00 0.00 0.00 0.00 27 L 8.60 4.62 0.00 1.81 1.74 1.02 0.68 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 28 S 8.59 4.82 0.00 3.99 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.47 4.39 1.24 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 30 G 9.53 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.65 4.44 0.00 2.74 2.68 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 0.00 0.00 0.00 0.00 32 I 8.37 4.59 1.90 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 1.36 0.81 0.99 0.00 0.00 33 L 8.77 5.02 0.00 1.72 1.60 1.02 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.41 5.25 0.00 2.25 1.79 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 2.23 2.15 0.00 35 V 8.51 4.41 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 0.63 0.00 0.00 0.41 0.00 0.00 36 I 8.94 4.03 1.88 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 1.12 0.54 0.91 0.00 0.00 37 L 7.64 4.70 0.00 1.65 1.37 0.83 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.34 3.35 0.00 1.56 1.24 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 1.47 1.47 0.00 39 G 7.72 3.98 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 0.00 0.00 0.00 40 E 8.63 4.17 0.00 2.11 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 2.28 2.31 0.00 41 D 8.65 4.48 0.00 2.70 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 42 G 8.12 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.69 4.71 0.00 3.21 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 44 W 9.67 4.82 0.00 3.48 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 45 T 8.33 5.26 4.32 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 46 V 8.29 5.58 2.20 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 1.08 0.00 0.00 1.00 0.00 0.00 47 E 8.67 5.01 0.00 1.99 1.75 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 2.23 2.31 0.00 48 R 9.07 4.44 0.00 1.79 1.73 0.00 3.33 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 49 N 9.76 4.43 0.00 2.87 2.85 0.00 0.00 7.38 7.98 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 50 G 8.51 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 0.00 0.00 0.00 0.00 51 Q 7.73 4.09 0.00 2.32 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 52 R 8.12 4.74 0.00 1.70 1.60 0.00 3.18 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.51 0.00 53 G 7.84 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 54 F 8.33 5.43 0.00 2.82 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 55 V 9.20 5.23 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 0.98 0.00 0.00 1.03 0.00 0.00 56 P 0.00 4.93 0.00 1.97 1.59 0.00 3.30 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.05 0.00 57 G 8.19 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.74 4.04 0.00 3.89 3.85 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 0.00 0.00 0.00 0.00 59 Y 7.83 4.67 0.00 2.91 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 60 L 8.15 5.05 0.00 1.31 1.62 0.66 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.53 4.60 0.00 2.20 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 2.14 2.22 0.00 62 K 8.50 3.20 0.00 1.43 1.50 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.06 0.95 7.81 63 L 7.78 4.22 0.00 1.46 1.55 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.42 4.62 0.00 3.78 3.72 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 0.00 0.00 0.00 65 G 8.69 4.25 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 0.00 66 P 0.00 4.54 0.00 2.18 2.18 0.00 3.70 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 1.98 1.94 0.00 67 S 7.06 4.60 0.00 3.83 3.70 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 0.00 0.00 0.00 0.00 68 S 8.65 3.74 0.00 4.05 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.92 3.75 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 0.00 0.00 0.00