NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2792 8.1127 117.2806 55.6785 31.2146 175.6095 2 M 3.6687 8.6602 116.5795 58.2742 31.8389 176.4999 3 K 3.9596 8.8401 120.5746 59.4079 32.7748 178.2023 4 Q 3.9766 7.9898 117.9216 58.9306 28.7678 178.3477 5 L 3.9816 7.9353 119.9021 58.0870 41.7090 179.5647 6 E 3.9940 8.2725 118.3120 59.5279 29.3605 179.2315 7 D 4.3902 8.1947 119.0606 56.8515 40.7487 178.7015 8 K 3.8407 8.3625 120.7079 59.4653 32.2050 178.6606 9 V 3.5512 7.7728 118.5253 66.4799 31.4318 177.8697 10 E 3.9314 7.9876 117.3966 59.3586 29.1905 179.0632 11 E 3.9803 8.1780 119.4270 59.0818 29.6313 178.8761 12 L 3.9663 8.2382 119.5564 57.6156 41.7148 179.1372 13 L 3.6634 8.1467 120.6585 58.0194 41.9232 178.9979 14 S 4.1666 7.8955 112.7288 61.1357 62.2183 176.3331 15 K 3.9563 7.7647 120.9017 59.2120 31.8260 178.9246 16 K 3.7896 8.0389 120.0138 60.0920 32.0691 178.3526 17 Y 4.5829 7.7262 116.6222 61.3498 37.8384 178.1139 18 H 4.2579 8.3355 119.4036 59.1112 29.9760 177.4656 19 L 3.9492 8.3571 121.1967 57.8513 41.5650 179.1385 20 E 4.0290 8.6554 118.9304 59.7224 29.3281 179.3423 21 N 4.3971 8.3636 116.3843 56.0720 38.5674 177.1990 22 E 3.8833 7.9300 120.5381 59.0783 29.7426 178.8723 23 V 3.5647 8.3241 118.4935 66.1520 31.4598 177.9583 24 A 4.0582 8.1309 120.2095 54.9125 17.8879 179.9768 25 R 3.9022 7.4723 115.9322 59.2578 30.5618 178.7470 26 L 4.1266 7.9223 118.6593 57.9026 41.7610 179.5730 27 K 3.8898 7.9244 118.2320 59.5511 31.7732 179.0686 28 K 3.8770 7.4832 118.7521 59.5453 32.1686 178.1793 29 L 4.1997 7.7937 118.7493 56.9241 42.1188 176.9323 30 V 4.0351 7.4959 116.3469 61.7456 32.7007 174.8981 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 4.28 0.00 1.97 2.16 0.00 3.34 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 2 M 8.66 3.67 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.71 0.00 3 K 8.84 3.96 0.00 1.86 1.79 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.53 7.81 4 Q 7.99 3.98 0.00 2.37 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.65 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 5 L 7.94 3.98 0.00 1.87 1.72 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.27 3.99 0.00 2.14 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 2.53 0.00 7 D 8.19 4.39 0.00 2.97 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 8.36 3.84 0.00 1.91 1.94 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.47 7.81 9 V 7.77 3.55 2.19 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 1.04 0.00 0.00 0.92 0.00 0.00 10 E 7.99 3.93 0.00 2.05 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 2.33 2.41 0.00 11 E 8.18 3.98 0.00 2.05 2.18 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 0.00 2.29 2.33 0.00 12 L 8.24 3.97 0.00 1.88 1.64 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.15 3.66 0.00 1.59 1.55 0.47 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.90 4.17 0.00 4.08 3.96 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 15 K 7.76 3.96 0.00 1.95 1.83 0.00 1.73 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.43 7.81 16 K 8.04 3.79 0.00 1.68 1.71 0.00 1.56 0.00 0.00 1.48 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.44 7.81 17 Y 7.73 4.58 0.00 3.08 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 18 H 8.34 4.26 0.00 3.25 3.49 0.00 5.58 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 19 L 8.36 3.95 0.00 1.87 1.70 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.66 4.03 0.00 2.07 2.06 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 2.38 2.57 0.00 21 N 8.36 4.40 0.00 2.76 2.85 0.00 0.00 6.68 6.99 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 22 E 7.93 3.88 0.00 2.04 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 2.28 2.28 0.00 23 V 8.32 3.56 2.33 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 0.96 0.00 0.00 0.93 0.00 0.00 24 A 8.13 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.47 3.90 0.00 1.99 1.99 0.00 3.17 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 26 L 7.92 4.13 0.00 1.70 1.71 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.92 3.89 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.57 7.81 28 K 7.48 3.88 0.00 1.87 1.99 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 29 L 7.79 4.20 0.00 1.68 1.86 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.50 4.04 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 0.75 0.00 0.00 0.93 0.00 0.00