NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6447 8.4093 118.2170 53.0093 38.4482 173.0612 2 S 4.3935 8.3728 113.0740 56.6646 64.9451 169.2366 3 V 3.6931 8.2212 118.1720 60.4132 32.8360 175.4845 4 N 4.3900 8.7696 122.7353 52.4921 39.1832 174.0160 5 P 4.2351 0.0000 0.0000 65.4432 31.6458 177.7442 6 C 4.4029 9.3933 116.5695 57.4856 40.7935 172.6113 7 C 4.5793 7.8106 120.8112 57.9641 32.2016 172.3763 8 D 4.6699 8.6717 127.3211 51.9627 40.3552 175.1120 9 P 4.3811 0.0000 0.0000 64.9936 31.7144 177.9023 10 Q 4.1433 8.4199 118.4911 58.0781 28.7099 176.8879 11 T 4.3773 7.7262 105.2139 60.3630 70.5885 173.3979 12 C 4.0182 8.1479 121.0829 60.4101 30.6111 171.8731 13 K 4.7984 7.4993 114.9633 53.0204 36.4856 174.1882 14 P 4.6837 0.0000 0.0000 62.9814 31.9081 176.8655 15 I 3.7856 8.4043 123.5755 61.3260 38.3960 175.4232 16 E 4.0413 8.6238 126.5284 57.7620 29.9185 176.5647 17 G 4.0520 9.1056 114.4074 45.2960 0.0000 173.6055 18 K 4.1665 7.6280 118.3615 55.8644 33.3636 175.9899 19 H 4.5189 8.4613 117.1224 57.2279 29.9534 172.7177 20 C 4.7295 7.2375 111.2362 54.8715 44.2243 173.9987 21 I 3.9493 8.2369 119.5475 62.4778 37.7780 176.1204 22 S 4.4889 7.7502 110.6443 56.9765 65.9432 171.9982 23 G 4.2839 8.8604 105.6704 42.6044 0.0000 173.3311 24 P 4.3639 0.0000 0.0000 65.0032 31.4836 177.8611 25 C 5.0184 8.5406 116.5300 56.5158 40.7231 171.9173 26 C 5.6333 8.1432 119.4274 54.7260 45.3359 173.0150 27 E 4.6647 9.1498 126.8085 56.0873 32.3914 174.6064 28 N 4.0960 9.7038 123.0449 54.7803 36.4231 175.6714 29 C 4.1844 8.2120 111.1241 57.6803 38.7352 172.4698 30 Y 4.9058 7.4464 117.1963 55.5654 40.6873 174.8079 31 F 5.1772 8.7150 120.8100 57.5098 39.2757 175.6957 32 L 4.3249 9.0281 123.5086 54.4263 43.0860 176.6241 33 R 4.2067 8.7017 122.2659 56.3170 31.2079 176.0817 34 S 4.5448 8.6898 120.4363 60.3190 63.1960 174.6439 35 G 3.9331 9.0248 112.9734 45.1482 0.0000 173.9246 36 T 4.0291 7.8388 117.4334 64.1311 69.5222 173.5025 37 I 4.4743 8.5432 127.6230 61.3921 37.2328 174.5417 38 C 4.7974 8.9510 121.7782 55.9890 44.3338 174.1542 39 Q 4.4847 7.5276 121.0460 54.8568 31.8648 173.5666 40 R 4.6137 8.5950 125.9470 55.7327 31.0450 176.3668 41 A 3.8115 9.2457 125.8450 52.3205 18.9551 176.7797 42 R 3.4649 9.1861 115.6303 60.3524 30.0653 177.4576 43 G 3.9470 8.3639 114.5886 47.0047 0.0000 173.5106 44 D 4.3891 7.6411 121.2439 52.7624 40.5069 176.1146 45 G 3.9858 8.7508 109.6852 45.3904 0.0000 172.6562 46 N 4.7384 7.8683 118.2175 52.2694 37.8520 174.5322 47 N 4.7669 8.3778 120.6275 51.7178 41.3030 173.8928 48 D 4.7895 8.4261 120.2630 53.3015 42.9154 175.5273 49 Y 5.2329 8.2978 119.0642 55.9676 41.4255 176.2876 50 C 4.5298 9.2612 120.8568 57.7793 40.9718 175.1103 51 T 3.6470 8.6470 111.8912 62.1419 69.1388 176.2438 52 G 3.9939 8.3865 108.9060 46.1312 0.0000 173.3802 53 I 4.0744 7.3519 110.3038 59.9299 38.8625 175.1105 54 T 4.3784 6.6407 109.7101 59.7265 71.6748 171.7390 55 P 4.7557 0.0000 0.0000 62.9504 32.2130 175.3976 56 D 4.9204 7.8087 118.9851 52.9376 40.7345 176.4559 57 C 4.6752 8.2218 119.3129 53.9625 42.9436 170.7896 58 P 4.4145 0.0000 0.0000 61.6301 31.6230 176.7203 59 R 3.9677 8.5423 122.9887 56.2367 30.4845 175.6058 60 N 4.2551 9.1975 123.9293 54.4177 39.1950 175.4203 61 R 4.1878 8.5885 125.0045 58.6387 30.5096 176.7669 62 Y 4.0449 7.9995 114.4889 59.5356 38.2410 175.3863 63 N 4.6480 8.4261 122.2903 53.3760 39.3079 174.0407 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 N 8.41 4.64 0.00 2.82 2.94 0.00 0.00 6.02 6.76 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 2 S 8.37 4.39 0.00 4.06 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 3 V 8.22 3.69 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 0.73 0.00 0.00 0.93 0.00 0.00 4 N 8.77 4.39 0.00 2.69 2.71 0.00 0.00 6.95 7.71 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 5 P 0.00 4.24 0.00 2.17 2.15 0.00 3.78 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 1.95 1.97 0.00 6 C 9.39 4.40 0.00 2.98 3.14 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 0.00 0.00 0.00 7 C 7.81 4.58 0.00 2.89 2.91 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 8 D 8.67 4.67 0.00 2.68 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.38 0.00 2.21 2.15 0.00 3.80 0.00 0.00 3.81 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 10 Q 8.42 4.14 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 11 T 7.73 4.38 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 1.20 0.00 0.00 12 C 8.15 4.02 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.50 4.80 0.00 1.60 1.64 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.52 7.81 14 P 0.00 4.68 0.00 1.86 1.89 0.00 3.67 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 1.98 2.08 0.00 15 I 8.40 3.79 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.72 0.87 0.00 0.00 16 E 8.62 4.04 0.00 1.92 1.86 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 2.30 2.32 0.00 17 G 9.11 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.63 4.17 0.00 1.64 1.58 0.00 1.03 0.00 0.00 1.23 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.33 7.81 19 H 8.46 4.52 0.00 2.27 1.69 0.00 5.69 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.24 4.73 0.00 3.07 2.95 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 21 I 8.24 3.95 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.87 0.89 0.00 0.00 22 S 7.75 4.49 0.00 3.93 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 23 G 8.86 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.36 0.00 2.19 2.22 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 25 C 8.54 5.02 0.00 3.16 3.14 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 0.00 0.00 0.00 26 C 8.14 5.63 0.00 3.01 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 27 E 9.15 4.66 0.00 2.02 1.78 0.00 0.00 0.00 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 2.31 0.00 28 N 9.70 4.10 0.00 3.00 2.90 0.00 0.00 7.18 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 29 C 8.21 4.18 0.00 2.57 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 7.45 4.91 0.00 2.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.71 5.18 0.00 3.08 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.03 4.32 0.00 1.70 1.66 1.02 0.62 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 33 R 8.70 4.21 0.00 1.92 1.84 0.00 3.21 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 34 S 8.69 4.54 0.00 3.99 3.94 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 35 G 9.02 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 36 T 7.84 4.03 4.31 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 1.26 0.00 0.00 37 I 8.54 4.47 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.60 0.84 0.00 0.00 38 C 8.95 4.80 0.00 2.95 3.20 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 39 Q 7.53 4.48 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.14 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 40 R 8.60 4.61 0.00 1.70 1.80 0.00 3.24 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 41 A 9.25 3.81 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 9.19 3.46 0.00 1.80 1.83 0.00 3.36 0.00 0.00 3.22 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 43 G 8.36 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 44 D 7.64 4.39 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.75 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 46 N 7.87 4.74 0.00 2.93 2.85 0.00 0.00 6.83 7.68 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 47 N 8.38 4.77 0.00 2.04 2.44 0.00 0.00 7.12 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 48 D 8.43 4.79 0.00 2.51 2.66 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 0.00 0.00 0.00 0.00 49 Y 8.30 5.23 0.00 2.82 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 50 C 9.26 4.53 0.00 2.92 3.04 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 51 T 8.65 3.65 4.16 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 1.17 0.00 0.00 52 G 8.39 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.35 4.07 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.58 0.83 0.00 0.00 54 T 6.64 4.38 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 55 P 0.00 4.76 0.00 2.54 2.61 0.00 3.75 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 56 D 7.81 4.92 0.00 2.82 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 57 C 8.22 4.68 0.00 2.94 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.10 1.97 0.00 3.94 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 59 R 8.54 3.97 0.00 1.77 1.86 0.00 3.27 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 60 N 9.20 4.26 0.00 3.07 2.79 0.00 0.00 6.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.59 4.19 0.00 1.71 1.72 0.00 3.30 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 62 Y 8.00 4.04 0.00 3.25 3.03 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 0.00 63 N 8.43 4.65 0.00 2.76 3.21 0.00 0.00 6.82 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00