NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9749 8.3393 109.7363 45.7786 0.0000 172.9764 2 S 4.2970 8.3675 118.1772 56.3970 65.1753 172.2320 3 S 4.3079 8.7844 119.0165 59.3477 63.9982 175.5781 4 G 4.0720 7.7847 120.4723 44.1035 0.0000 174.2244 5 S 3.8987 8.8900 119.9734 59.1193 62.7188 174.3458 6 S 4.6743 8.4755 121.5990 56.9141 63.5918 174.5618 7 G 3.9441 8.5184 121.1392 45.5195 0.0000 174.3676 8 L 4.8654 8.8119 123.0331 53.1513 46.1394 173.7769 9 K 5.1274 8.6282 122.6604 55.1396 35.9470 175.2961 10 M 5.0240 8.9924 121.8310 53.9794 37.2325 174.0425 11 Q 4.9214 8.3165 117.9680 54.6929 32.3976 174.3742 12 V 4.4939 8.0032 119.4564 61.6790 32.0887 176.1775 13 L 3.8124 8.7806 131.5494 57.3821 42.6715 176.6098 14 Y 4.9535 7.4751 114.5968 55.8588 41.9557 174.8304 15 E 4.3261 9.1262 125.0771 56.5202 30.6757 175.5514 16 F 5.0449 9.4775 128.3805 56.3061 43.3763 172.8252 17 E 4.8160 7.1307 123.7121 54.1375 31.5031 175.1687 18 A 4.7963 8.6186 128.5218 50.9207 20.2625 176.8108 19 R 4.6796 8.3355 115.3259 55.1704 30.6661 174.5307 20 N 4.8922 7.8119 113.8025 51.9923 39.6510 173.1257 21 P 4.4638 0.0000 0.0000 64.3357 31.9054 177.1311 22 R 4.3544 7.7044 115.0986 57.1796 30.5873 176.1287 23 E 5.0281 7.8741 116.9732 55.1907 31.1403 175.6250 24 L 4.9320 7.9970 122.9225 53.4944 45.1229 176.2406 25 T 4.4408 8.6605 122.2301 63.7937 69.2571 174.3324 26 V 4.6695 8.8351 117.8002 59.8798 36.3990 174.9984 27 V 4.7698 7.7240 116.4688 59.4512 34.5378 175.1574 28 Q 4.1566 8.5899 122.9716 56.4646 29.8406 175.5379 29 G 3.8134 8.8402 113.0886 46.2999 0.0000 172.6849 30 E 4.7013 7.9073 119.2874 53.9760 32.7288 174.5695 31 K 4.7298 8.5423 124.2719 55.0058 33.6140 175.5674 32 L 4.9334 8.7107 124.3920 52.7836 46.6078 174.8861 33 E 4.9834 8.2288 119.9573 54.4783 31.8055 175.3311 34 V 4.3097 8.5611 127.0884 63.2393 32.1062 174.5409 35 L 4.5692 9.2444 125.0189 55.9489 44.1904 176.7181 36 D 4.7132 8.1411 123.0524 51.9885 43.2437 175.3484 37 H 3.6170 8.0367 125.8020 54.6604 28.7855 175.8905 38 S 4.1922 6.9812 114.1776 60.9433 63.4635 174.1030 39 K 4.2319 7.6994 120.3722 55.9528 32.8462 176.8624 40 R 4.1832 8.6689 122.1368 58.6849 30.1565 176.9617 41 W 4.7999 8.2407 115.8743 55.2350 30.6292 176.2718 42 W 5.1645 9.0201 123.8748 55.7375 31.1620 174.8665 43 L 5.2468 8.7898 124.8254 53.6800 43.8618 175.7765 44 V 5.4025 8.4687 118.0600 58.5072 36.3450 174.1417 45 K 5.2087 8.3963 121.1240 54.9675 36.2537 174.7742 46 N 5.0721 8.6625 121.9904 50.5906 39.9034 175.5869 47 E 3.9099 8.8391 117.1280 59.5346 29.5203 178.7413 48 A 3.9729 8.0085 120.1923 54.1949 18.3639 178.1277 49 G 4.1009 8.1446 101.9154 45.1184 0.0000 173.4810 50 R 4.5398 8.8268 120.6400 55.0226 31.7499 175.5135 51 S 5.6913 8.1381 117.9789 55.8585 65.3867 173.4112 52 G 4.2237 8.3903 109.7881 44.3218 0.0000 170.6323 53 Y 5.3627 8.4306 118.0886 57.7225 39.5052 175.1709 54 I 4.9606 9.4550 116.4445 58.4356 41.9156 172.6208 55 P 3.2674 0.0000 0.0000 62.0523 31.4728 177.1951 56 S 3.4233 8.0008 118.5273 60.1800 62.2661 175.6694 57 N 4.1923 7.6205 116.5639 55.8481 38.5867 175.3993 58 I 4.4130 7.9001 111.3041 60.3243 37.9322 174.2486 59 L 5.7344 7.4091 120.3770 52.7029 43.4270 175.8573 60 E 4.7004 8.6098 122.2504 53.5569 33.6471 174.0368 61 P 4.6324 0.0000 0.0000 62.1334 29.6456 172.9892 62 L 4.3116 8.0903 126.1598 54.9131 40.9440 177.5176 63 S 4.3323 8.3331 119.7226 58.6378 63.8899 173.4454 64 G 4.0558 7.8253 109.1962 44.4678 0.0000 172.4248 65 P 4.4001 0.0000 0.0000 63.5904 31.5068 176.6972 66 S 3.8993 7.2634 112.9971 58.7471 62.4601 173.9504 67 S 4.2678 8.7215 121.6709 57.7249 62.7579 174.1085 68 G 3.7285 8.4056 109.9633 46.3773 0.0000 172.3914 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 G 8.34 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 2 S 8.37 4.30 0.00 4.02 3.79 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 3 S 8.78 4.31 0.00 3.88 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 4 G 7.78 4.07 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 0.00 0.00 0.00 5 S 8.89 3.90 0.00 3.86 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 6 S 8.48 4.67 0.00 3.85 3.83 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 7 G 8.52 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 8 L 8.81 4.87 0.00 1.68 1.39 0.97 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.63 5.13 0.00 1.63 1.65 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.44 7.81 10 M 8.99 5.02 0.00 1.91 1.94 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 11 Q 8.32 4.92 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.19 0.00 12 V 8.00 4.49 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 1.01 0.00 0.00 0.94 0.00 0.00 13 L 8.78 3.81 0.00 1.37 1.18 0.70 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.48 4.95 0.00 2.87 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 15 E 9.13 4.33 0.00 2.11 1.93 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 2.33 2.56 0.00 16 F 9.48 5.04 0.00 3.12 2.88 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 0.00 0.00 0.00 17 E 7.13 4.82 0.00 1.76 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 18 A 8.62 4.80 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.34 4.68 0.00 1.87 1.93 0.00 3.09 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 20 N 7.81 4.89 0.00 2.95 2.91 0.00 0.00 5.91 7.81 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 21 P 0.00 4.46 0.00 2.22 2.23 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 22 R 7.70 4.35 0.00 2.47 2.33 0.00 2.79 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 23 E 7.87 5.03 0.00 2.06 2.20 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 2.40 2.50 0.00 24 L 8.00 4.93 0.00 1.45 1.55 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.66 4.44 4.29 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 1.27 0.00 0.00 26 V 8.84 4.67 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.09 0.00 0.00 27 V 7.72 4.77 2.10 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 0.66 0.00 0.00 0.99 0.00 0.00 28 Q 8.59 4.16 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.44 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 29 G 8.84 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 0.00 0.00 0.00 30 E 7.91 4.70 0.00 2.05 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 31 K 8.54 4.73 0.00 1.67 1.73 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.44 7.81 32 L 8.71 4.93 0.00 1.59 1.55 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 33 E 8.23 4.98 0.00 2.13 1.79 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 2.22 2.40 0.00 34 V 8.56 4.31 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 1.18 0.00 0.00 35 L 9.24 4.57 0.00 1.61 1.64 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.14 4.71 0.00 2.77 2.59 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 37 H 8.04 3.62 0.00 1.40 1.93 0.00 5.76 0.00 0.00 0.00 0.00 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 6.98 4.19 0.00 3.48 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 39 K 7.70 4.23 0.00 1.77 1.76 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.48 7.81 40 R 8.67 4.18 0.00 2.08 2.22 0.00 3.48 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 41 W 8.24 4.80 0.00 3.07 3.28 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 0.00 0.00 0.00 0.00 42 W 9.02 5.16 0.00 3.30 3.17 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 43 L 8.79 5.25 0.00 1.93 1.60 0.48 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.47 5.40 2.20 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 1.14 0.00 0.00 0.98 0.00 0.00 45 K 8.40 5.21 0.00 1.77 1.58 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.56 7.81 46 N 8.66 5.07 0.00 2.99 2.94 0.00 0.00 7.20 7.26 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 47 E 8.84 3.91 0.00 1.96 2.07 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 2.32 2.39 0.00 48 A 8.01 3.97 1.29 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 0.00 0.00 49 G 8.14 4.10 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 0.00 0.00 0.00 50 R 8.83 4.54 0.00 1.89 1.86 0.00 3.08 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 51 S 8.14 5.69 0.00 3.77 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 52 G 8.39 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.43 5.36 0.00 3.20 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.46 4.96 1.71 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.59 1.05 0.00 0.00 55 P 0.00 3.27 0.00 1.64 0.99 0.00 2.96 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.22 0.00 56 S 8.00 3.42 0.00 2.72 3.19 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 57 N 7.62 4.19 0.00 2.53 2.76 0.00 0.00 6.77 7.34 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 58 I 7.90 4.41 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.85 1.01 0.00 0.00 59 L 7.41 5.73 0.00 1.26 1.32 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.61 4.70 0.00 1.74 1.72 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 0.00 2.16 2.09 0.00 61 P 0.00 4.63 0.00 2.07 2.10 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 62 L 8.09 4.31 0.00 1.65 1.72 0.96 1.01 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 63 S 8.33 4.33 0.00 3.84 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 64 G 7.83 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 0.00 0.00 0.00 65 P 0.00 4.40 0.00 2.19 2.18 0.00 3.80 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 1.98 1.95 0.00 66 S 7.26 3.90 0.00 3.95 3.86 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 67 S 8.72 4.27 0.00 3.86 3.79 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 68 G 8.41 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