NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2599 8.2644 123.5843 52.2730 19.4535 176.1952 3 R 4.1231 7.0214 122.9051 56.4253 31.3878 174.5661 4 K 3.7954 8.3435 120.1337 59.9527 32.7540 178.4028 5 A 4.1135 7.9452 120.0874 55.1777 17.8671 179.4402 6 L 4.0870 7.8270 117.3068 57.6213 41.6625 179.4267 7 I 3.8520 8.1556 112.8100 63.5044 37.4320 177.3688 8 E 4.1794 7.8230 119.7166 58.3322 29.5374 177.6861 9 K 3.9572 8.0799 117.6696 57.7793 32.3192 176.8470 10 A 4.1700 7.2787 119.0624 53.2797 19.8726 177.4140 11 K 4.1971 7.3494 118.0241 59.2358 34.9305 177.2150 12 R 3.9671 7.7855 121.5389 56.8977 29.6447 177.5622 13 T 4.4282 7.9992 124.0068 61.2646 67.3962 173.9823 14 P 4.0618 0.0000 0.0000 64.3224 32.0816 177.1261 15 K 3.9300 6.3928 116.8784 54.4873 35.3862 176.5263 16 F 3.7962 5.8687 116.3872 56.4154 36.8107 176.9405 17 K 3.9057 9.0214 125.1983 60.1820 32.2743 179.0638 18 V 3.6578 8.0989 111.3550 64.4975 31.7774 177.8411 19 R 3.9909 8.4136 117.5747 59.1077 29.9599 176.1788 20 A 3.8118 7.3978 122.3061 52.5222 17.9492 176.1535 21 Y 4.8783 7.4983 119.5445 55.3303 40.7498 175.6882 22 T 4.0986 8.5324 111.4376 61.7629 69.4937 173.1688 23 R 4.7065 7.8268 119.4305 55.9194 32.3520 173.3235 24 C 4.5510 9.3325 126.2882 59.8076 32.1732 173.8111 25 V 4.0289 8.3635 118.3994 63.4993 32.0224 178.4119 26 R 4.1336 8.1776 118.2053 58.4604 30.2437 176.3167 27 C 4.9266 7.6926 109.7762 55.8939 33.0069 174.7397 28 G 3.9341 8.4685 110.2085 45.3911 0.0000 173.5165 29 R 4.3640 7.6412 119.3843 55.2446 31.9191 176.0780 30 A 4.3390 8.6314 126.8839 53.2563 20.8190 177.2554 31 R 4.3473 7.8353 113.0015 55.9304 32.0802 176.1995 32 S 3.4479 8.3261 112.7015 59.3792 61.1512 171.7686 33 V 4.7792 7.0944 118.5106 60.7646 32.6105 174.5084 34 Y 4.1252 8.8107 126.5260 57.9446 37.7855 178.4828 35 R 4.6216 8.4947 126.7229 55.7472 28.8647 177.2088 36 F 4.5758 8.2499 118.0744 59.1011 42.7529 174.3201 37 F 4.7754 8.7417 117.0266 56.1089 40.4607 176.7319 38 G 4.0305 8.3169 107.9707 46.0297 0.0000 173.4871 39 L 5.1532 7.7058 120.6224 53.4563 44.2296 174.7504 40 C 5.6528 8.4425 112.1645 55.2519 32.7955 174.5376 41 R 4.2195 8.9625 116.8964 60.3220 28.6275 177.1759 42 I 3.9950 7.9189 120.2268 62.2058 37.2335 177.0534 43 C 4.0851 7.9637 118.5124 62.6193 28.4221 176.2853 44 L 3.7036 8.4623 121.7839 58.0725 41.5305 178.6535 45 R 4.0438 7.6623 115.4885 58.0749 29.8745 177.5046 46 E 4.1203 7.7374 118.0777 59.5287 29.8977 178.1871 47 L 4.0080 8.0803 118.3868 57.7714 41.6113 179.4111 48 A 3.9178 7.7488 119.6858 55.8513 18.3741 179.1070 49 H 4.1835 7.7551 113.0008 57.9151 28.8904 177.6160 50 K 4.0640 8.3925 119.7300 56.7500 31.6964 176.7504 51 G 4.2509 8.4112 120.9716 46.2957 0.0000 175.1875 52 Q 4.0071 8.4034 115.9852 56.5761 28.1632 176.0036 53 L 4.6897 7.9602 119.2860 51.9531 43.2182 174.2171 54 P 4.2842 0.0000 0.0000 64.2468 31.2651 175.3743 55 G 3.9372 7.7606 115.4479 45.6259 0.0000 173.7853 56 V 3.3104 7.0276 121.6977 61.0683 30.3866 175.4641 57 R 4.6178 8.0864 126.7477 53.7582 33.1380 175.0683 58 K 3.9748 8.5621 123.3584 55.9816 30.4404 175.9300 59 A 4.0120 7.8568 127.2629 51.8991 19.1162 177.3108 60 S 4.6871 8.1438 110.6513 57.7228 64.7574 177.1031 61 W 4.8329 8.3343 124.5787 56.7960 27.9488 174.7408 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 A 8.26 4.26 1.30 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 0.00 0.00 3 R 7.02 4.12 0.00 1.97 1.81 0.00 3.23 0.00 0.00 3.32 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 4 K 8.34 3.80 0.00 1.91 1.83 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.61 7.81 5 A 7.95 4.11 1.34 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 0.00 0.00 6 L 7.83 4.09 0.00 2.01 1.83 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.16 3.85 1.89 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 1.66 0.52 0.98 0.00 0.00 8 E 7.82 4.18 0.00 2.28 2.14 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 2.27 2.34 0.00 9 K 8.08 3.96 0.00 2.01 1.87 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.46 7.81 10 A 7.28 4.17 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.35 4.20 0.00 1.81 1.68 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.37 7.81 12 R 7.79 3.97 0.00 1.86 1.95 0.00 3.03 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 13 T 8.00 4.43 4.20 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 1.24 0.00 0.00 14 P 0.00 4.06 0.00 2.09 2.13 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 15 K 6.39 3.93 0.00 1.56 0.81 0.00 0.94 0.00 0.00 1.16 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.11 1.31 7.81 16 F 5.87 3.80 0.00 3.19 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.02 3.91 0.00 1.95 2.14 0.00 1.57 0.00 0.00 1.85 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.56 7.81 18 V 8.10 3.66 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 0.77 0.00 0.00 1.11 0.00 0.00 19 R 8.41 3.99 0.00 1.99 2.13 0.00 3.33 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 20 A 7.40 3.81 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.50 4.88 0.00 3.06 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.53 4.10 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 1.26 0.00 0.00 23 R 7.83 4.71 0.00 1.85 1.83 0.00 3.29 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.53 0.00 24 C 9.33 4.55 0.00 3.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.36 4.03 2.11 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 0.76 0.00 0.00 1.02 0.00 0.00 26 R 8.18 4.13 0.00 1.83 2.00 0.00 3.16 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 27 C 7.69 4.93 0.00 3.04 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 28 G 8.47 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 29 R 7.64 4.36 0.00 2.04 1.85 0.00 3.22 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 30 A 8.63 4.34 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.84 4.35 0.00 1.82 1.86 0.00 3.35 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 32 S 8.33 3.45 0.00 4.16 4.06 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 0.00 0.00 0.00 33 V 7.09 4.78 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 1.34 0.00 0.00 1.06 0.00 0.00 34 Y 8.81 4.13 0.00 3.41 3.23 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 0.00 35 R 8.49 4.62 0.00 1.97 2.07 0.00 3.02 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 36 F 8.25 4.58 0.00 2.92 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 37 F 8.74 4.78 0.00 3.28 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 38 G 8.32 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.71 5.15 0.00 1.87 1.68 0.89 0.63 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 40 C 8.44 5.65 0.00 3.31 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 41 R 8.96 4.22 0.00 2.11 2.36 0.00 3.09 0.00 0.00 3.27 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 42 I 7.92 3.99 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.78 0.94 0.00 0.00 43 C 7.96 4.09 0.00 2.97 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.46 3.70 0.00 1.43 1.76 0.42 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.66 4.04 0.00 1.88 1.93 0.00 3.31 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.66 0.00 46 E 7.74 4.12 0.00 2.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 47 L 8.08 4.01 0.00 1.64 1.70 0.92 1.08 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 48 A 7.75 3.92 1.25 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 0.00 0.00 0.00 49 H 7.76 4.18 0.00 3.21 3.39 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.39 4.06 0.00 1.90 1.61 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 51 G 8.41 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 0.00 0.00 0.00 0.00 52 Q 8.40 4.01 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 53 L 7.96 4.69 0.00 1.65 1.59 0.70 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.28 0.00 2.14 2.07 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 55 G 7.76 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.03 3.31 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 1.01 0.00 0.00 57 R 8.09 4.62 0.00 1.93 1.74 0.00 3.32 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 58 K 8.56 3.97 0.00 1.72 1.73 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.33 7.81 59 A 7.86 4.01 1.34 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 0.00 0.00 60 S 8.14 4.69 0.00 3.79 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.33 4.83 0.00 3.28 3.10 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 0.00 0.00 0.00