NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3282 8.2649 123.5710 52.4687 19.2311 177.7415 3 K 4.3337 8.8722 111.8169 62.6747 33.8937 177.6669 4 H 4.1641 8.1218 117.3925 53.9138 32.0053 176.4161 5 P 4.3142 0.0000 0.0000 64.2978 31.3601 175.3231 6 V 4.4492 7.7375 118.9103 59.7739 33.7320 171.5611 7 P 4.4409 0.0000 0.0000 62.7041 31.8185 176.9360 8 K 4.1716 8.5602 120.1280 59.0233 32.4409 177.1866 9 K 4.5083 7.4302 115.0706 54.7376 35.8214 175.2037 10 K 4.0975 8.5073 122.6843 56.7632 32.7854 176.1631 11 T 4.4951 8.0986 114.1975 59.9548 70.6144 175.1804 12 S 4.1994 8.5380 120.3026 58.7990 64.8798 176.1903 13 K 4.0257 8.4644 122.9492 59.7727 32.0192 179.2457 14 S 4.1385 8.0504 113.3775 60.7451 62.3894 175.4497 15 K 4.0768 8.0018 121.4875 59.9691 31.7956 178.5375 16 R 3.9478 7.8544 116.9597 59.1073 29.7492 177.0028 17 D 4.6710 8.9317 118.7595 56.2532 41.5583 178.1445 18 M 4.0221 7.6879 118.6087 58.9347 32.2053 177.9157 19 R 3.7987 8.3666 117.3209 58.2098 29.9447 177.3956 20 R 3.7173 6.8272 115.2658 57.7564 31.1780 177.8798 21 S 4.3471 8.3607 111.8333 59.5577 62.6328 174.0291 22 H 4.9347 8.2240 116.3807 56.2439 30.3832 173.2266 23 H 4.8634 8.1519 115.1855 55.4951 28.8642 174.2549 24 A 4.3728 7.8897 123.3681 50.8126 18.9822 178.4517 25 L 4.1006 8.5169 123.5609 55.4302 42.3386 176.7119 26 T 4.4398 8.1648 111.1597 59.5753 70.1865 174.6237 27 A 4.1386 8.4155 129.2746 51.0810 19.1185 175.1529 28 P 4.4143 0.0000 0.0000 63.0622 32.2207 176.7917 29 N 4.7742 8.1172 119.3751 51.7309 37.5076 173.9655 30 L 4.3886 7.7674 120.2277 55.0857 42.8209 176.9067 31 T 4.6471 9.1511 118.9074 61.8161 72.4122 172.5508 32 E 4.8444 8.4283 123.7745 54.4110 31.1142 175.0518 33 C 4.0716 9.3740 128.9928 59.3215 31.9383 172.7857 34 P 4.3488 0.0000 0.0000 65.3257 32.4436 177.0572 35 Q 4.2029 7.8127 113.7380 55.5259 27.0718 177.3875 36 C 3.5154 9.0452 126.7701 60.0881 29.8424 174.2909 37 H 4.7603 8.7760 114.7975 55.6069 27.2910 175.0435 38 G 3.8983 7.6803 106.8032 45.7821 0.0000 173.5928 39 K 4.9389 8.5142 120.5232 56.3540 33.2258 176.3538 40 K 4.6954 10.3161 121.9112 55.3814 37.1780 174.1405 41 L 4.7764 8.2448 121.5008 53.1270 43.4960 175.5128 42 S 4.0554 8.6664 120.3481 60.7361 62.4794 173.8877 43 H 4.5253 9.2719 122.6944 56.4267 25.7238 173.3999 44 H 5.0129 8.3665 116.0357 53.7897 32.2957 172.7386 45 I 4.4163 7.9976 120.6723 60.4912 38.0179 175.7528 46 C 4.2605 8.5541 125.1854 58.7274 31.0916 172.6090 47 P 4.4241 0.0000 0.0000 64.8743 30.9318 176.7357 48 N 4.7348 8.0633 115.3303 53.9839 39.3390 175.1850 49 C 4.6575 7.7570 109.5004 56.4465 31.3065 174.9009 50 G 3.9563 8.8049 109.0969 46.3594 0.0000 173.0141 51 Y 5.4897 7.6571 116.6319 56.9449 39.6670 175.0206 52 Y 4.7184 8.1366 117.9091 56.9998 39.4709 172.9656 53 D 5.0755 9.0907 121.7409 54.4814 38.8591 175.6941 54 G 3.7797 7.4954 106.0188 43.7971 0.0000 170.2605 55 R 4.2075 7.7195 120.8897 54.6362 30.7195 176.5939 56 Q 4.1240 8.7320 125.5420 58.3202 29.3539 177.0254 57 V 3.9459 7.3877 116.6690 61.7454 32.5202 175.6384 58 L 3.8755 8.8776 125.1383 56.3740 41.9761 177.2283 59 A 4.2332 7.8305 125.4999 51.6064 18.5673 176.2407 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 4.33 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.87 4.33 0.00 1.82 1.84 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.59 7.81 4 H 8.12 4.16 0.00 3.22 2.54 0.00 5.73 0.00 0.00 0.00 0.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.31 0.00 2.03 2.01 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 6 V 7.74 4.45 2.27 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 0.66 0.00 0.00 0.94 0.00 0.00 7 P 0.00 4.44 0.00 2.20 2.10 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 8 K 8.56 4.17 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.40 7.81 9 K 7.43 4.51 0.00 1.70 1.66 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.35 7.81 10 K 8.51 4.10 0.00 1.71 1.71 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 T 8.10 4.50 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 1.21 0.00 0.00 12 S 8.54 4.20 0.00 4.03 3.87 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 13 K 8.46 4.03 0.00 1.72 1.87 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 S 8.05 4.14 0.00 3.88 3.80 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 15 K 8.00 4.08 0.00 1.90 1.82 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.59 7.81 16 R 7.85 3.95 0.00 1.89 2.21 0.00 3.46 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 17 D 8.93 4.67 0.00 2.73 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 18 M 7.69 4.02 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.90 0.00 19 R 8.37 3.80 0.00 1.87 1.93 0.00 3.24 0.00 0.00 3.35 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 20 R 6.83 3.72 0.00 1.95 2.05 0.00 3.21 0.00 0.00 3.28 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 21 S 8.36 4.35 0.00 3.87 4.02 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 0.00 0.00 0.00 22 H 8.22 4.93 0.00 3.00 3.24 0.00 5.64 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.15 4.86 0.00 3.14 3.26 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.89 4.37 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 25 L 8.52 4.10 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 1.70 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.16 4.44 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 1.22 0.00 0.00 27 A 8.42 4.14 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.05 2.01 0.00 3.66 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 2.03 2.08 0.00 29 N 8.12 4.77 0.00 2.67 2.73 0.00 0.00 7.03 7.78 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 30 L 7.77 4.39 0.00 1.57 1.59 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 31 T 9.15 4.65 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 1.21 0.00 0.00 32 E 8.43 4.84 0.00 1.96 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 2.16 2.39 0.00 33 C 9.37 4.07 0.00 3.04 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.35 0.00 2.06 2.10 0.00 3.70 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 2.00 2.11 0.00 35 Q 7.81 4.20 0.00 1.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.86 0.00 0.00 0.00 0.00 0.00 2.28 1.88 0.00 36 C 9.05 3.52 0.00 3.02 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 37 H 8.78 4.76 0.00 3.29 3.37 0.00 5.62 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 7.68 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.51 4.94 0.00 1.66 1.76 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.44 7.81 40 K 10.32 4.70 0.00 1.81 1.91 0.00 1.37 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.38 7.81 41 L 8.24 4.78 0.00 1.73 1.37 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.67 4.06 0.00 3.86 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.27 4.53 0.00 3.54 3.59 0.00 5.69 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.37 5.01 0.00 3.16 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.00 4.42 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.35 1.08 0.00 0.00 46 C 8.55 4.26 0.00 2.96 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.42 0.00 2.23 2.19 0.00 3.84 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 48 N 8.06 4.73 0.00 2.73 2.90 0.00 0.00 6.72 7.66 0.00 0.00 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 C 7.76 4.66 0.00 2.79 2.85 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 0.00 0.00 0.00 50 G 8.80 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 51 Y 7.66 5.49 0.00 2.97 2.90 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 0.00 0.00 0.00 52 Y 8.14 4.72 0.00 2.89 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 53 D 9.09 5.08 0.00 2.71 3.06 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 54 G 7.50 3.78 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 0.00 0.00 0.00 55 R 7.72 4.21 0.00 1.17 1.61 0.00 3.74 0.00 0.00 3.69 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.00 0.00 56 Q 8.73 4.12 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 57 V 7.39 3.95 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 0.81 0.00 0.00 0.95 0.00 0.00 58 L 8.88 3.88 0.00 1.67 1.62 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.83 4.23 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