NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2278 8.4331 120.2324 56.2908 31.7315 175.6180 2 G 3.4548 8.0111 112.2809 45.9501 0.0000 169.6526 3 E 4.4591 8.3971 127.1835 55.4519 31.3189 175.5948 4 C 3.9992 7.6710 118.1273 56.3049 39.6082 173.1119 5 G 3.5769 8.2204 110.2052 44.9015 0.0000 172.1241 6 G 3.5526 8.3912 122.2772 45.6560 0.0000 175.3499 7 F 4.4942 8.6193 124.6091 60.5307 39.8075 174.4037 8 W 5.4817 7.6429 128.3609 55.9917 31.6747 171.2031 9 W 4.3761 8.8376 132.3934 54.3321 32.8000 174.4990 10 K 4.2479 8.3855 126.9595 57.4679 32.0139 175.0311 11 C 5.0826 10.5960 119.4158 52.6849 45.3670 173.7789 12 G 3.8849 8.3303 106.9870 45.7498 0.0000 175.6719 13 S 4.3270 8.0926 118.2578 59.2581 61.7026 173.9189 14 G 4.2701 8.5750 120.7579 46.2393 0.0000 171.3400 15 K 4.7172 7.8146 117.2291 53.5218 36.3190 174.0914 16 P 4.5657 0.0000 0.0000 61.7240 32.6597 175.3185 17 A 4.3852 8.0015 120.9298 51.4534 19.5018 178.0475 18 C 4.6269 8.3489 117.4557 56.2256 35.7145 174.5489 19 C 4.5847 8.3134 119.0905 56.3741 40.3253 173.5656 20 P 4.0714 0.0000 0.0000 65.1077 31.0544 177.8655 21 K 4.1539 7.8214 115.9586 57.5164 32.9658 176.2264 22 Y 4.8717 7.0479 114.5825 56.9897 39.8171 175.7783 23 V 4.6148 8.9420 113.7299 59.9547 36.9626 173.6066 24 C 5.0632 8.7668 123.3520 55.8073 43.8842 173.4009 25 S 4.4299 8.8032 122.2743 57.7605 62.6809 172.4864 26 P 4.4073 0.0000 0.0000 65.4945 31.6220 177.9000 27 K 3.7702 7.9735 117.1447 58.2044 32.9727 176.9564 28 W 5.0288 7.6174 118.6202 54.4490 31.8391 177.0195 29 G 4.0826 8.4684 111.2754 44.5336 0.0000 172.3680 30 L 5.1169 7.4331 119.7206 53.3980 47.4898 177.4736 31 C 5.2305 9.5263 120.9981 56.4503 37.6036 172.6587 32 N 5.7574 9.4932 120.9332 51.1169 41.0835 173.9826 33 F 4.7047 9.2457 117.6720 56.9869 39.5107 174.2227 34 P 4.5154 0.0000 0.0000 65.5580 31.5163 176.7366 35 M 4.3613 7.6606 112.2284 53.7899 32.8340 172.9532 36 P 4.3823 0.0000 0.0000 63.2129 31.4615 176.2434 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 E 8.43 4.23 0.00 1.98 2.04 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 2.22 2.33 0.00 2 G 8.01 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.40 4.46 0.00 1.81 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.82 0.00 4 C 7.67 4.00 0.00 2.78 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 5 G 8.22 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.39 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.62 4.49 0.00 2.99 3.11 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 8 W 7.64 5.48 0.00 3.01 2.96 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 0.00 0.00 0.00 9 W 8.84 4.38 0.00 3.41 3.01 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 0.00 0.00 0.00 10 K 8.39 4.25 0.00 1.41 1.60 0.00 1.36 0.00 0.00 1.25 0.00 0.00 2.75 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.02 1.09 7.81 11 C 10.60 5.08 0.00 2.93 3.22 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 0.00 12 G 8.33 3.88 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 0.00 0.00 0.00 13 S 8.09 4.33 0.00 3.99 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 14 G 8.57 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.72 0.00 1.82 1.79 0.00 2.01 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.49 7.81 16 P 0.00 4.57 0.00 2.02 2.02 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 17 A 8.00 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 18 C 8.35 4.63 0.00 3.19 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 19 C 8.31 4.58 0.00 3.17 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 20 P 0.00 4.07 0.00 2.01 2.11 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 21 K 7.82 4.15 0.00 1.17 1.38 0.00 1.55 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.43 7.81 22 Y 7.05 4.87 0.00 2.88 2.83 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 23 V 8.94 4.61 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 0.65 0.00 0.00 1.08 0.00 0.00 24 C 8.77 5.06 0.00 3.03 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 25 S 8.80 4.43 0.00 4.04 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 26 P 0.00 4.41 0.00 2.17 2.15 0.00 3.84 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 1.95 1.95 0.00 27 K 7.97 3.77 0.00 0.96 1.61 0.00 1.27 0.00 0.00 1.50 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 0.81 7.81 28 W 7.62 5.03 0.00 3.38 3.06 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 0.00 0.00 0.00 0.00 29 G 8.47 4.08 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 0.00 0.00 0.00 30 L 7.43 5.12 0.00 1.48 1.07 0.49 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 31 C 9.53 5.23 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 32 N 9.49 5.76 0.00 2.77 3.09 0.00 0.00 7.12 8.22 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 33 F 9.25 4.70 0.00 3.33 3.13 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 34 P 0.00 4.52 0.00 2.26 2.27 0.00 4.17 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 35 M 7.66 4.36 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 36 P 0.00 4.38 0.00 2.07 2.04 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00