NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7985 8.3249 115.8120 55.4737 40.8041 177.1008 2 V 2.8251 7.4172 115.2475 61.4307 31.0715 170.0185 3 N 4.8687 8.4595 124.6075 53.8965 42.4371 173.5746 4 Q 3.9990 9.4538 119.4063 59.7635 28.9792 178.7944 5 H 4.2975 8.3787 115.7784 58.1043 29.8829 175.2046 6 L 4.7468 8.2626 117.0647 54.5378 43.9613 178.1814 7 C 4.2011 8.1761 118.4565 62.1236 31.6805 175.4141 8 G 4.4322 8.8045 108.9063 46.7285 0.0000 175.5707 9 S 4.1552 7.5477 115.0836 60.6685 62.9669 175.0764 10 H 5.0310 7.7215 120.1563 55.7731 29.7779 176.7298 11 L 4.1123 7.6745 120.8857 57.7730 41.5042 179.5737 12 V 3.5949 7.5448 112.0500 64.1719 30.9156 178.2896 13 E 4.3019 7.8016 117.0118 59.6192 29.3761 179.2244 14 A 3.7325 7.8553 119.9322 54.4344 18.3339 179.2603 15 L 3.5904 7.6724 117.9204 58.1606 41.7148 179.2411 16 Y 4.0233 7.7819 116.3256 58.8637 37.9307 177.3624 17 L 3.4650 6.5023 121.9728 57.7003 42.1408 178.6434 18 V 3.6184 7.2090 117.5518 66.1147 31.9295 177.5817 19 C 4.2588 7.6810 116.1395 61.4686 27.8269 174.8425 20 G 3.9775 8.7633 108.7430 46.0321 0.0000 173.5314 21 E 4.2622 8.5514 122.2156 56.3740 30.8993 176.5496 22 R 4.6112 7.5228 117.7060 54.5960 32.6908 174.9530 23 G 4.5887 7.7532 107.8191 46.1952 0.0000 172.2958 24 F 4.3937 8.0272 112.2808 56.2757 39.7322 172.7648 25 F 4.6994 7.6514 117.1376 55.1706 39.3031 174.3363 26 Y 4.7867 8.4948 126.3238 55.7254 40.5967 174.1243 27 T 4.4251 7.7687 117.0395 58.9375 69.8804 172.9738 28 P 4.3600 0.0000 0.0000 62.8794 30.4694 176.7750 29 K 4.4102 7.4807 118.7273 58.4955 34.8798 175.4022 30 T 4.1503 7.4868 117.7975 64.0132 69.7494 173.1161 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 4.80 0.00 3.10 3.29 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 0.00 2 V 7.42 2.83 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 0.50 0.00 0.00 1.00 0.00 0.00 3 N 8.46 4.87 0.00 2.78 2.73 0.00 0.00 6.64 7.19 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 4 Q 9.45 4.00 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.59 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 5 H 8.38 4.30 0.00 3.15 3.39 0.00 5.92 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.26 4.75 0.00 1.74 1.67 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.18 4.20 0.00 3.07 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 G 8.80 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.55 4.16 0.00 3.95 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 10 H 7.72 5.03 0.00 3.15 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.67 4.11 0.00 1.81 1.76 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.54 3.59 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 0.14 0.00 0.00 0.81 0.00 0.00 13 E 7.80 4.30 0.00 2.27 2.09 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 2.43 2.57 0.00 14 A 7.86 3.73 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 15 L 7.67 3.59 0.00 1.42 0.32 1.06 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.78 4.02 0.00 3.31 3.31 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 0.00 17 L 6.50 3.46 0.00 1.27 1.68 0.69 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.21 3.62 2.09 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 0.90 0.00 0.00 0.88 0.00 0.00 19 C 7.68 4.26 0.00 3.20 2.99 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 20 G 8.76 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 21 E 8.55 4.26 0.00 1.98 2.02 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 2.28 2.27 0.00 22 R 7.52 4.61 0.00 1.86 1.90 0.00 3.12 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 23 G 7.75 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 4.39 0.00 2.90 2.80 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 25 F 7.65 4.70 0.00 3.08 3.09 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 26 Y 8.49 4.79 0.00 3.04 2.78 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 0.00 0.00 0.00 27 T 7.77 4.43 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 1.17 0.00 0.00 28 P 0.00 4.36 0.00 2.21 2.17 0.00 3.52 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.01 0.00 29 K 7.48 4.41 0.00 1.63 1.77 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.39 7.81 30 T 7.49 4.15 4.23 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 1.21 0.00 0.00