NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.2102 7.9133 114.0200 61.4483 33.4699 174.0820 3 D 5.4492 8.6813 125.0522 52.5314 43.9349 173.5823 4 Y 5.1097 9.1785 118.1045 56.3282 42.8295 173.9345 5 I 4.7666 8.6708 122.7353 59.3966 40.5526 174.6882 6 V 4.1248 8.7877 129.8904 63.0056 31.8067 176.0329 7 E 4.2038 9.5113 127.3901 57.0962 31.2276 176.0881 8 Y 4.8601 7.7470 115.2444 55.8557 42.0321 175.0421 9 D 4.8391 9.1674 123.3463 55.2403 41.7296 175.2644 10 Y 4.8349 9.2263 123.2635 55.8500 42.6445 173.4831 11 D 5.0070 7.2218 124.4667 51.8388 43.0839 176.0755 12 A 4.2818 8.3339 127.1982 52.5930 18.9141 177.1399 13 V 4.1289 8.8560 120.9777 63.0616 33.3587 175.2249 14 H 5.0709 7.8485 115.1080 53.4599 32.3744 173.9293 15 D 4.4193 8.8067 120.8520 57.3205 40.8241 177.4028 16 D 4.7038 8.0856 116.4266 53.3954 39.9720 175.3716 17 E 5.2425 7.8774 119.5489 55.6257 31.3396 175.3680 18 L 4.7495 8.9720 122.4725 53.8295 43.5158 176.4092 19 T 4.6957 8.5168 120.1755 62.8614 69.4045 174.1946 20 I 4.9274 8.9365 119.5120 59.1718 41.6003 174.5463 21 R 5.1354 9.1652 121.8719 53.9298 34.2847 175.1988 22 V 3.8091 8.6428 121.9724 65.1197 31.7372 176.0748 23 G 4.0470 8.9205 115.9059 45.2506 0.0000 173.7715 24 E 4.1474 8.1351 119.4673 56.5364 30.7821 176.1055 25 I 4.6942 8.1710 123.8529 60.2032 38.7047 175.1947 26 I 4.3805 8.7828 129.4759 60.4096 38.4228 175.2229 27 R 4.8808 9.0470 124.3531 54.6689 31.9499 175.4765 28 N 4.2676 8.7905 117.7808 54.8554 37.5770 174.6130 29 V 4.2841 8.0178 117.9860 63.0331 33.0038 176.2397 30 K 4.8085 9.3373 126.0060 54.2187 36.2654 175.9717 31 K 4.4616 8.7506 122.4199 56.6266 32.7270 176.3226 32 L 4.7190 8.1839 122.4972 52.7403 44.2155 176.2755 33 Q 4.0357 8.9254 122.2949 59.3112 28.9568 177.6811 34 E 4.0261 8.0155 117.8628 55.9315 29.9028 175.7742 35 E 4.0216 8.7052 125.5714 57.5752 30.2531 176.7193 36 G 4.1885 9.4273 114.1557 44.7047 0.0000 172.1510 37 W 5.0308 7.4997 117.0380 54.6218 32.5715 174.6625 38 L 4.6767 8.4402 122.1180 52.7167 45.7766 174.8508 39 E 5.1092 8.2189 120.5518 54.7922 33.0813 174.9267 40 G 4.3146 8.7393 111.3390 46.2511 0.0000 171.0404 41 E 5.3105 8.7694 120.8695 54.2403 32.1566 174.6039 42 L 4.7652 8.8621 128.3791 53.7100 45.6203 175.6274 43 N 4.0330 9.7291 124.9603 54.8066 37.0904 174.5018 44 G 3.9604 8.1958 102.5965 45.7417 0.0000 172.6378 45 R 4.7290 7.8327 119.7802 54.3901 33.5715 174.1162 46 R 5.1308 8.3424 123.6289 54.8890 32.5802 175.4223 47 G 4.2080 8.9133 109.1260 46.3854 0.0000 171.8579 48 M 5.4141 8.6451 118.0990 54.1698 34.1745 174.9641 49 F 5.0854 8.2860 113.1577 55.3372 41.3489 171.4040 50 P 3.6706 0.0000 0.0000 61.8738 32.4100 176.7984 51 D 4.4439 8.7433 121.5090 55.0206 39.8199 177.2951 52 N 4.7318 8.0924 116.0427 53.5667 37.9947 175.3261 53 F 4.6600 8.2842 117.0837 58.0289 39.6742 175.1651 54 V 5.1746 7.5791 112.6118 59.6073 36.2354 174.4857 55 K 4.7131 9.1260 122.2904 54.4064 35.5160 174.9982 56 E 2.7125 8.6686 128.4858 56.0793 30.1267 175.8782 57 I 4.0429 8.1680 128.9416 60.4831 38.0507 176.3486 58 K 4.1105 8.4774 125.6009 56.4723 32.3631 176.0171 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 2 V 7.91 4.21 2.28 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 0.82 0.00 0.00 1.09 0.00 0.00 3 D 8.68 5.45 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.18 5.11 0.00 2.82 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.67 4.77 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.64 0.94 0.00 0.00 6 V 8.79 4.12 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 1.06 0.00 0.00 0.88 0.00 0.00 7 E 9.51 4.20 0.00 1.83 1.33 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 0.00 2.37 2.45 0.00 8 Y 7.75 4.86 0.00 2.74 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.17 4.84 0.00 2.69 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.23 4.83 0.00 2.69 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.22 5.01 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.33 4.28 1.37 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 13 V 8.86 4.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.89 0.00 0.00 14 H 7.85 5.07 0.00 3.17 3.11 0.00 5.68 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.81 4.42 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.09 4.70 0.00 2.84 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 17 E 7.88 5.24 0.00 2.25 2.22 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 2.81 2.36 0.00 18 L 8.97 4.75 0.00 1.63 1.64 0.93 0.91 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 19 T 8.52 4.70 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 20 I 8.94 4.93 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.81 0.78 0.00 0.00 21 R 9.17 5.14 0.00 1.68 1.81 0.00 3.38 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 22 V 8.64 3.81 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 1.00 0.00 0.00 23 G 8.92 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 4.15 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 25 I 8.17 4.69 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.79 0.93 0.00 0.00 26 I 8.78 4.38 1.84 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.16 0.85 0.00 0.00 27 R 9.05 4.88 0.00 1.89 2.06 0.00 2.94 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 28 N 8.79 4.27 0.00 2.88 2.91 0.00 0.00 7.11 7.82 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 29 V 8.02 4.28 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 1.13 0.00 0.00 30 K 9.34 4.81 0.00 1.65 1.63 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.57 7.81 31 K 8.75 4.46 0.00 1.64 1.74 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.43 7.81 32 L 8.18 4.72 0.00 1.65 1.52 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.93 4.04 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 34 E 8.02 4.03 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.02 0.00 35 E 8.71 4.02 0.00 1.96 1.91 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 2.31 2.27 0.00 36 G 9.43 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 0.00 0.00 0.00 37 W 7.50 5.03 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.44 4.68 0.00 0.27 0.92 0.48 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.22 5.11 0.00 2.00 1.69 0.00 0.00 0.00 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 2.26 0.00 40 G 8.74 4.31 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 0.00 0.00 0.00 41 E 8.77 5.31 0.00 2.07 1.96 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 2.22 2.24 0.00 42 L 8.86 4.77 0.00 1.65 1.41 0.94 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 43 N 9.73 4.03 0.00 2.81 2.79 0.00 0.00 7.18 7.98 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 44 G 8.20 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 0.00 0.00 0.00 45 R 7.83 4.73 0.00 1.89 1.74 0.00 3.09 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 46 R 8.34 5.13 0.00 1.75 1.85 0.00 3.32 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 47 G 8.91 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 M 8.65 5.41 0.00 2.07 2.31 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 49 F 8.29 5.09 0.00 2.86 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 50 P 0.00 3.67 0.00 1.68 0.87 0.00 2.51 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 51 D 8.74 4.44 0.00 2.86 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 52 N 8.09 4.73 0.00 2.73 2.92 0.00 0.00 6.02 7.43 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 53 F 8.28 4.66 0.00 3.19 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.58 5.17 2.37 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 0.73 0.00 0.00 1.23 0.00 0.00 55 K 9.13 4.71 0.00 1.82 1.61 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.33 7.81 56 E 8.67 2.71 0.00 1.28 1.55 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 2.02 1.84 0.00 57 I 8.17 4.04 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.87 0.00 0.00 58 K 8.48 4.11 0.00 1.66 1.64 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.27 1.29 7.81