NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.6779 8.4244 119.1980 53.8236 40.1656 172.8859 7 D 4.6729 8.5226 120.6988 55.3187 47.0772 174.7184 8 D 5.0390 7.7977 119.0360 52.2847 43.0801 176.3975 9 H 4.2737 8.5288 117.3680 58.3052 28.4813 175.7299 10 E 3.9141 8.4564 121.3502 59.6775 29.2222 179.2492 11 S 4.1499 7.6161 114.6287 61.6530 62.9544 176.9597 12 K 3.9798 7.9270 120.5764 59.3579 31.8153 178.9227 13 L 3.9641 8.3184 121.0426 58.1166 41.9201 178.9639 14 S 4.0671 8.3214 113.4372 61.4968 62.3238 176.0722 15 I 3.6664 7.6602 122.4433 64.4557 36.7479 178.3702 16 L 4.0038 7.9401 119.6148 57.9929 41.2663 179.2616 17 M 4.0975 7.8786 117.4697 58.8993 32.0687 178.4301 18 D 4.4644 7.8522 117.2010 57.2323 41.0369 178.1680 19 M 4.0881 8.1525 118.5902 56.7363 32.1585 175.7371 20 F 4.7848 8.2221 118.9737 54.9338 40.7267 173.8058 21 P 4.7976 0.0000 0.0000 61.4537 30.9407 175.6635 22 A 4.6637 7.6496 121.7146 54.1769 26.3000 177.9794 23 I 3.8043 7.2597 117.4200 61.1413 37.8482 176.9551 24 S 4.2873 8.5278 120.3991 58.0773 64.8729 175.1794 25 K 3.8577 8.7610 124.8619 59.9158 31.8342 179.1037 26 S 4.0924 8.0377 114.8259 61.5271 62.8125 176.4373 27 K 3.9122 7.6454 120.8021 59.4548 31.9501 178.6447 28 L 3.7108 7.7738 119.1439 57.8550 41.5448 179.4067 29 Q 3.8717 8.1340 119.3527 59.0078 28.9811 178.2525 30 V 3.5603 7.7470 119.4688 66.2879 31.5541 177.6400 31 H 4.1720 8.2148 114.8554 58.5766 28.2963 177.0495 32 L 4.0249 7.6655 123.1816 57.8550 41.6853 178.9674 33 L 4.0024 7.7890 117.3255 57.9269 41.9135 179.1090 34 E 4.1826 8.1318 118.3824 59.3012 29.4889 178.9072 35 N 4.8755 8.6368 116.3748 53.7417 39.5509 174.8525 36 N 4.3542 8.9439 114.1332 54.8694 37.0130 173.9696 37 N 4.2875 8.3538 109.0460 54.3031 35.6731 174.2612 38 D 4.7611 8.0439 116.9440 53.2392 42.7362 176.4460 39 L 4.4170 8.4763 125.7997 56.9364 43.1662 178.2534 40 D 4.2987 8.3172 117.6587 57.4369 41.6111 177.9610 41 L 3.9235 8.1698 120.0415 58.4869 42.1252 178.6395 42 T 3.7855 7.2865 114.2727 66.9872 68.3977 176.5547 43 I 4.0039 8.1620 121.6736 64.2992 36.8216 178.4867 44 G 3.8181 8.1508 106.6497 48.1003 0.0000 175.4275 45 L 3.9797 7.9345 122.8946 57.6790 42.1405 178.9441 46 L 3.8950 7.8874 119.0348 57.4504 41.1866 179.3592 47 L 4.2045 8.0942 118.9534 57.8691 41.7696 179.4746 48 K 4.1267 7.6200 118.3741 59.8786 32.2443 178.6426 49 E 3.9356 7.7052 118.7808 59.0054 30.0200 177.8282 50 N 4.6843 7.5614 115.0451 53.6854 38.9699 175.7377 51 D 4.3967 7.9343 119.4014 55.9061 41.8363 175.5815 52 D 4.4169 7.3380 112.4889 53.4984 43.9394 175.7375 53 K 4.0878 9.1788 126.6626 58.6598 32.4285 176.9371 54 S 4.2973 7.4092 116.2208 59.0507 63.2996 175.5651 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 6 N 8.42 4.68 0.00 2.59 2.70 0.00 0.00 6.64 7.52 0.00 0.00 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 D 8.52 4.67 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.80 5.04 0.00 2.71 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 9 H 8.53 4.27 0.00 3.42 3.53 0.00 5.50 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.46 3.91 0.00 2.10 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 2.44 2.54 0.00 11 S 7.62 4.15 0.00 3.74 3.92 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 12 K 7.93 3.98 0.00 1.95 1.88 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 13 L 8.32 3.96 0.00 1.57 1.82 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.32 4.07 0.00 3.90 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 15 I 7.66 3.67 1.98 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 1.76 0.83 0.86 0.00 0.00 16 L 7.94 4.00 0.00 2.04 1.99 1.07 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.88 4.10 0.00 2.00 2.30 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.62 0.00 18 D 7.85 4.46 0.00 2.59 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 19 M 8.15 4.09 0.00 1.12 1.85 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.85 0.00 20 F 8.22 4.78 0.00 3.07 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 21 P 0.00 4.80 0.00 2.20 2.13 0.00 3.88 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 2.02 1.97 0.00 22 A 7.65 4.66 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 23 I 7.26 3.80 1.91 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.86 0.00 0.00 24 S 8.53 4.29 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.76 3.86 0.00 1.85 1.87 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.55 7.81 26 S 8.04 4.09 0.00 3.89 3.89 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 0.00 0.00 0.00 27 K 7.65 3.91 0.00 1.85 1.94 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.47 7.81 28 L 7.77 3.71 0.00 1.91 1.71 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.13 3.87 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 30 V 7.75 3.56 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 0.95 0.00 0.00 0.99 0.00 0.00 31 H 8.21 4.17 0.00 3.40 3.54 0.00 5.53 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.67 4.02 0.00 1.90 1.86 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.79 4.00 0.00 1.82 1.73 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.13 4.18 0.00 2.14 2.01 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 2.54 2.50 0.00 35 N 8.64 4.88 0.00 2.82 2.84 0.00 0.00 7.33 6.72 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 36 N 8.94 4.35 0.00 2.83 2.86 0.00 0.00 6.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.35 4.29 0.00 2.84 2.94 0.00 0.00 6.73 7.86 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 38 D 8.04 4.76 0.00 2.84 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 39 L 8.48 4.42 0.00 1.77 1.71 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.32 4.30 0.00 2.76 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 41 L 8.17 3.92 0.00 1.85 1.75 0.92 0.79 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 42 T 7.29 3.79 4.34 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 0.96 0.00 0.00 43 I 8.16 4.00 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.95 1.07 0.00 0.00 44 G 8.15 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.93 3.98 0.00 1.77 1.79 0.90 0.69 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 46 L 7.89 3.90 0.00 1.79 1.19 0.21 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.09 4.20 0.00 1.78 1.79 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.62 4.13 0.00 1.85 2.07 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.44 7.81 49 E 7.71 3.94 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.41 0.00 50 N 7.56 4.68 0.00 2.76 2.82 0.00 0.00 7.27 8.38 0.00 0.00 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 D 7.93 4.40 0.00 2.88 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 52 D 7.34 4.42 0.00 2.60 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.18 4.09 0.00 1.79 1.85 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.43 7.81 54 S 7.41 4.30 0.00 3.64 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00