NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 5.0481 8.3249 122.8239 58.3910 39.9757 174.3245 2 V 3.6694 8.1787 120.2283 59.4929 35.3897 171.8967 3 N 4.3668 8.6847 122.2255 54.3536 38.9469 173.1837 4 Q 4.3696 7.9010 124.3369 55.7891 31.5737 172.5836 5 H 4.7464 8.6727 114.2853 55.3771 29.8429 175.3193 6 L 4.8595 7.5692 122.8797 58.0413 42.0523 175.6568 7 C 3.5689 8.5470 116.8380 59.2759 32.0544 177.0159 8 G 3.5577 7.9889 115.0826 47.2510 0.0000 177.0844 9 S 4.1785 7.8914 115.2269 61.1136 62.7732 176.2176 10 H 4.4493 9.8286 119.6813 58.2325 28.5022 177.6057 11 L 3.8036 8.6652 121.8726 57.9384 40.9980 179.7276 12 V 2.9088 8.8371 118.9965 65.4818 31.0733 177.0308 13 E 4.6421 7.8967 114.3767 57.2459 29.7321 177.2386 14 A 4.4187 8.0808 121.3968 52.7006 19.8001 178.0285 15 L 4.0207 8.5186 119.5909 56.6741 41.9676 177.9116 16 Y 4.3218 7.5801 118.8238 60.3300 38.6976 177.1097 17 L 2.9202 6.7747 119.3246 56.9969 42.3290 178.0188 18 V 3.8322 6.9658 115.8045 63.5236 32.5911 176.7558 19 C 4.7325 7.8024 117.4370 58.6710 29.1704 173.3045 20 G 4.1444 7.1935 111.0613 46.0500 0.0000 174.2346 21 E 3.9872 8.3337 123.5831 58.6644 30.0467 179.0969 22 R 3.9843 8.0979 115.7036 56.3546 30.5416 177.1656 23 G 3.8229 9.8361 108.0957 44.8057 0.0000 172.2451 24 F 4.7378 7.1691 110.6711 57.7646 40.0560 173.8594 25 F 4.9759 9.0928 120.8235 58.2462 39.7383 172.0004 26 Y 4.6965 8.5324 124.0358 55.1135 39.4090 177.3626 27 T 4.0979 7.6407 118.8247 58.9895 68.5691 172.2070 28 P 4.4772 0.0000 0.0000 64.2986 32.8457 176.8148 29 K 4.6247 7.9902 116.7074 55.9448 34.0042 176.1929 30 T 4.1674 7.6599 112.2860 61.7030 69.0139 175.6010 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 F 8.32 5.05 0.00 2.87 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 2 V 8.18 3.67 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 0.42 0.00 0.00 0.93 0.00 0.00 3 N 8.68 4.37 0.00 2.64 2.77 0.00 0.00 6.81 7.74 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 4 Q 7.90 4.37 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 5 H 8.67 4.75 0.00 3.18 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.57 4.86 0.00 1.64 1.58 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.55 3.57 0.00 2.96 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.99 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.89 4.18 0.00 4.11 4.19 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.83 4.45 0.00 3.44 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.67 3.80 0.00 1.55 1.21 0.85 0.59 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 12 V 8.84 2.91 2.31 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 1.11 0.00 0.00 1.19 0.00 0.00 13 E 7.90 4.64 0.00 2.45 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.57 0.00 14 A 8.08 4.42 1.28 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 15 L 8.52 4.02 0.00 1.17 1.35 0.52 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.58 4.32 0.00 3.33 3.35 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 17 L 6.77 2.92 0.00 1.59 1.39 0.57 0.97 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 18 V 6.97 3.83 2.13 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 0.78 0.00 0.00 0.80 0.00 0.00 19 C 7.80 4.73 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 20 G 7.19 4.14 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 0.00 0.00 0.00 21 E 8.33 3.99 0.00 2.01 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 2.37 2.44 0.00 22 R 8.10 3.98 0.00 1.88 2.04 0.00 3.34 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 23 G 9.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.17 4.74 0.00 3.17 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 25 F 9.09 4.98 0.00 2.99 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.53 4.70 0.00 3.03 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.64 4.10 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 0.62 0.00 0.00 28 P 0.00 4.48 0.00 2.20 2.09 0.00 3.71 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 29 K 7.99 4.62 0.00 1.68 1.72 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.32 7.81 30 T 7.66 4.17 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 1.21 0.00 0.00