NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0422 8.0431 120.3138 62.7340 33.3741 176.2406 2 G 3.7286 9.0348 108.5169 43.3656 0.0000 169.5545 3 I 4.7005 8.1661 116.0672 59.2694 41.8324 173.6764 4 N 4.8914 8.4015 117.6254 51.2798 38.8245 172.5786 5 V 4.4505 7.4918 120.8187 60.0360 35.1720 174.7920 6 K 4.4979 8.4519 126.7857 56.5475 32.8734 174.3723 7 C 4.9820 8.1904 115.0757 54.1011 44.3746 173.4727 8 K 4.2225 8.5261 119.2699 56.7369 33.1806 175.2444 9 H 4.7880 7.0489 113.8465 54.7753 35.1682 172.9171 10 S 4.6654 7.7840 120.4976 58.4312 66.0158 179.7844 11 R 3.9906 7.5955 119.0854 59.3110 29.4836 178.7999 12 Q 4.0586 8.0421 116.3000 58.3517 29.0476 178.2346 13 C 4.4723 8.4077 119.6042 58.7180 44.2305 175.3218 14 L 3.9283 7.6786 121.0271 57.8176 41.1519 178.8838 15 K 3.8451 8.2272 117.9405 59.5944 31.9697 177.2591 16 P 4.3101 0.0000 0.0000 65.9183 31.3145 179.1841 17 C 4.2616 8.3092 116.3849 59.8080 34.8356 176.0016 18 K 4.0306 8.2510 121.3682 59.6118 31.5892 178.4136 19 D 4.3459 7.9407 117.0309 57.0648 41.2144 177.6991 20 A 4.1655 8.0231 120.4044 53.3491 18.4535 178.2465 21 G 3.9290 7.7699 104.6683 45.3362 0.0000 173.7788 22 M 4.3404 7.4123 119.2950 55.0021 32.6265 175.8053 23 R 4.1777 8.0923 119.3241 58.5243 30.7535 176.7454 24 F 4.4114 7.8951 115.8360 57.6582 40.7923 174.2713 25 G 4.3675 8.5290 105.5586 45.5467 0.0000 172.5798 26 K 4.7782 9.0811 125.9968 55.0672 36.5072 173.8636 27 C 4.9489 8.7514 125.6688 56.6362 44.1994 172.6773 28 T 4.6737 8.9535 120.5242 61.3853 70.2233 172.5434 29 N 4.2366 9.8921 122.8434 54.4924 37.4867 174.5860 30 G 3.9668 8.8262 100.4765 45.3202 0.0000 173.9909 31 K 4.7454 8.0321 117.8626 54.2448 36.3408 174.5696 32 C 4.7858 9.0547 122.5012 56.9147 44.2407 172.2959 33 H 5.1760 9.3485 125.8831 54.6690 32.5137 171.5860 34 C 5.6074 8.9551 121.0071 54.4522 44.0758 172.9540 35 T 4.9782 8.1634 108.8945 59.4876 72.0264 171.5032 36 P 4.8601 0.0000 0.0000 61.9243 32.7649 176.3961 37 K 4.1767 8.4681 118.2783 57.2983 32.5068 176.8076 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 V 8.04 4.04 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 0.92 0.00 0.00 1.01 0.00 0.00 2 G 9.03 3.73 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 0.00 0.00 0.00 3 I 8.17 4.70 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 0.92 0.00 0.00 4 N 8.40 4.89 0.00 2.63 2.73 0.00 0.00 6.58 7.72 0.00 0.00 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 V 7.49 4.45 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 0.99 0.00 0.00 0.94 0.00 0.00 6 K 8.45 4.50 0.00 1.74 1.71 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.49 7.81 7 C 8.19 4.98 0.00 3.08 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 8 K 8.53 4.22 0.00 1.71 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.33 1.40 7.81 9 H 7.05 4.79 0.00 3.13 3.11 0.00 5.82 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 7.78 4.67 0.00 3.84 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 11 R 7.60 3.99 0.00 1.89 1.98 0.00 3.18 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 12 Q 8.04 4.06 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 13 C 8.41 4.47 0.00 3.02 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.68 3.93 0.00 1.90 1.70 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.23 3.85 0.00 1.84 1.85 0.00 1.55 0.00 0.00 1.87 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.58 7.81 16 P 0.00 4.31 0.00 2.27 2.31 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.06 0.00 17 C 8.31 4.26 0.00 3.20 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 18 K 8.25 4.03 0.00 1.95 1.79 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.41 7.81 19 D 7.94 4.35 0.00 2.78 2.68 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 0.00 0.00 0.00 0.00 20 A 8.02 4.17 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 21 G 7.77 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 22 M 7.41 4.34 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 23 R 8.09 4.18 0.00 1.74 1.92 0.00 3.13 0.00 0.00 3.17 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.33 0.00 24 F 7.90 4.41 0.00 3.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.53 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.08 4.78 0.00 1.87 1.67 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.45 7.81 27 C 8.75 4.95 0.00 3.05 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 28 T 8.95 4.67 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 1.16 0.00 0.00 29 N 9.89 4.24 0.00 2.80 2.80 0.00 0.00 7.05 7.97 0.00 0.00 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 G 8.83 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 4.75 0.00 1.76 1.65 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.37 7.81 32 C 9.05 4.79 0.00 2.95 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 33 H 9.35 5.18 0.00 3.25 3.24 0.00 5.77 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 C 8.96 5.61 0.00 2.83 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 35 T 8.16 4.98 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 36 P 0.00 4.86 0.00 2.13 2.13 0.00 3.81 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 2.02 1.99 0.00 37 K 8.47 4.18 0.00 1.89 1.84 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.39 7.81