NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3313 8.2644 123.5843 52.3374 18.9986 175.9985 3 R 4.3788 7.7015 118.2525 53.8009 32.4112 174.5382 4 K 4.0762 8.3981 119.1620 59.2769 33.9767 177.2169 5 A 4.1528 7.9755 119.7570 54.1868 18.2170 178.7469 6 L 4.2811 7.7159 117.1194 56.7223 42.4606 178.7478 7 I 3.8351 7.2195 111.4167 63.4958 37.6221 177.4281 8 E 4.1348 7.9857 121.1492 58.6637 28.4079 177.9715 9 K 4.1017 7.9398 119.4975 59.3157 31.9746 178.0564 10 A 3.5415 7.8687 119.2856 53.5840 18.2867 178.7718 11 K 4.3809 8.0347 116.7336 57.3576 33.0481 177.1501 12 R 4.0703 7.0374 119.3800 56.1301 29.3762 176.6358 13 T 3.7168 8.8478 121.5372 65.7889 68.5503 178.6940 14 P 3.4167 0.0000 0.0000 63.9092 32.9682 175.2822 15 K 3.7133 8.5284 120.9946 55.8302 33.5102 178.1106 16 F 3.6449 6.1067 116.9689 56.5575 36.4863 177.2114 17 K 3.8331 8.8018 125.6096 59.4892 32.4814 179.0781 18 V 3.6247 8.0245 118.7854 66.1873 31.4471 177.0911 19 R 4.1808 8.1945 115.6331 57.4909 29.9056 176.8758 20 A 4.1669 7.5625 121.2911 52.1371 19.1121 176.5007 21 Y 4.6553 7.6332 114.6887 56.1126 39.8689 173.9821 22 T 4.0317 8.7159 112.5717 61.9738 68.9959 174.0508 23 R 5.7771 8.5959 122.5263 57.3076 30.9094 171.3924 24 C 3.7773 7.4314 118.6012 56.1577 32.4839 173.1476 25 V 3.3965 8.2999 126.9345 67.0487 30.9938 177.5882 26 R 3.9383 7.1814 118.9344 58.4906 30.2634 176.3725 27 C 4.3605 7.9620 111.6184 56.6497 31.1724 175.6190 28 G 3.8603 8.7811 108.3849 46.3221 0.0000 173.0313 29 R 3.8405 8.3428 120.0085 56.5071 30.6034 176.5928 30 A 4.5027 8.6099 125.1650 52.9595 21.2723 176.9041 31 R 4.3860 7.8416 112.7020 55.8851 32.1748 175.9455 32 S 3.5789 8.5206 112.8667 59.2315 60.0077 170.9465 33 V 5.0040 7.2652 110.2038 57.4129 34.1874 176.0433 34 Y 4.1570 9.2228 124.1418 57.8409 37.9809 176.4765 35 R 4.1363 8.8580 123.7147 59.7719 29.2430 177.9787 36 F 4.1976 8.5147 119.6839 60.3126 39.8045 175.9485 37 F 4.7293 8.5736 115.5385 56.3456 40.0717 177.7836 38 G 4.1637 8.8989 106.4418 45.7831 0.0000 173.6275 39 L 4.6093 7.5601 122.0049 54.1121 43.1185 174.3609 40 C 5.8728 8.4267 114.4100 55.2776 33.4047 174.9476 41 R 3.8871 8.2118 113.3357 60.3303 28.7247 178.2847 42 I 3.8612 7.9805 120.7628 62.5987 37.1352 177.8188 43 C 4.1680 7.7694 118.0832 62.9175 28.2966 176.2937 44 L 3.5633 8.0390 121.8438 58.0813 41.4438 178.6437 45 R 3.7481 7.5330 117.2771 60.3766 30.0905 177.3793 46 E 3.8937 8.7958 117.8312 59.3253 29.3248 178.9798 47 L 3.8872 8.3087 118.0838 58.3562 42.0109 179.5395 48 A 3.9271 8.0891 120.5703 56.0038 17.9804 179.4388 49 H 4.2337 7.9925 112.7982 58.1704 28.8272 177.3728 50 K 4.3316 8.4555 119.3661 56.4880 32.2329 177.7406 51 G 3.9081 7.6346 107.0098 45.9853 0.0000 173.4813 52 Q 4.4345 7.8935 115.7896 55.3389 29.0195 176.0252 53 L 4.7165 7.4826 119.2638 51.7011 42.7740 173.4969 54 P 4.1195 0.0000 0.0000 64.2280 31.9356 175.9754 55 G 4.2853 9.1372 114.9496 45.8457 0.0000 173.1624 56 V 3.6688 7.0678 120.2425 63.0774 30.4398 174.8290 57 R 4.5538 7.9667 125.7010 53.3946 32.4348 175.5015 58 K 3.8632 8.4865 122.6647 56.1682 31.9938 176.5642 59 A 4.2546 8.5555 129.8842 52.2677 18.7469 175.7121 60 S 5.5035 8.3260 121.0190 58.5604 64.7078 176.9514 61 W 4.6031 8.1952 124.4223 57.1722 27.2773 174.1252 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 1.30 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 7.70 4.38 0.00 1.90 1.86 0.00 3.18 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 4 K 8.40 4.08 0.00 1.91 1.77 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.55 7.81 5 A 7.98 4.15 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 7.72 4.28 0.00 1.75 1.80 1.05 0.93 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 7 I 7.22 3.84 1.89 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 1.61 0.54 0.98 0.00 0.00 8 E 7.99 4.13 0.00 2.25 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 2.27 2.34 0.00 9 K 7.94 4.10 0.00 1.91 1.91 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.49 7.81 10 A 7.87 3.54 1.24 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 0.00 0.00 0.00 11 K 8.03 4.38 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.39 1.61 7.81 12 R 7.04 4.07 0.00 1.88 1.88 0.00 3.19 0.00 0.00 3.33 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 13 T 8.85 3.72 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 1.18 0.00 0.00 14 P 0.00 3.42 0.00 2.06 2.32 0.00 3.51 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.07 0.00 15 K 8.53 3.71 0.00 1.75 1.60 0.00 1.31 0.00 0.00 1.15 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.53 7.81 16 F 6.11 3.64 0.00 3.16 3.20 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 0.00 17 K 8.80 3.83 0.00 1.95 2.13 0.00 1.53 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.52 7.81 18 V 8.02 3.62 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.99 0.00 0.00 19 R 8.19 4.18 0.00 1.95 2.09 0.00 3.40 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.76 0.00 20 A 7.56 4.17 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 7.63 4.66 0.00 2.97 2.91 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 0.00 0.00 0.00 22 T 8.72 4.03 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 1.34 0.00 0.00 23 R 8.60 5.78 0.00 1.95 1.93 0.00 3.30 0.00 0.00 4.01 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.48 0.00 24 C 7.43 3.78 0.00 3.07 3.20 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 0.00 25 V 8.30 3.40 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 0.85 0.00 0.00 1.02 0.00 0.00 26 R 7.18 3.94 0.00 1.97 1.89 0.00 3.08 0.00 0.00 3.28 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 27 C 7.96 4.36 0.00 3.14 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 28 G 8.78 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 0.00 0.00 0.00 29 R 8.34 3.84 0.00 1.89 1.91 0.00 3.11 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 30 A 8.61 4.50 1.22 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 31 R 7.84 4.39 0.00 1.81 1.86 0.00 3.35 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 32 S 8.52 3.58 0.00 4.01 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 33 V 7.27 5.00 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 1.38 0.00 0.00 1.04 0.00 0.00 34 Y 9.22 4.16 0.00 3.26 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 8.86 4.14 0.00 2.03 2.17 0.00 3.09 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 36 F 8.51 4.20 0.00 3.10 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 37 F 8.57 4.73 0.00 3.33 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 38 G 8.90 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.56 4.61 0.00 1.70 1.54 0.73 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.43 5.87 0.00 3.21 3.05 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 41 R 8.21 3.89 0.00 2.12 2.41 0.00 2.80 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 42 I 7.98 3.86 1.87 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 1.65 0.56 0.95 0.00 0.00 43 C 7.77 4.17 0.00 2.94 2.97 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 44 L 8.04 3.56 0.00 1.24 1.71 0.50 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.53 3.75 0.00 1.89 2.18 0.00 3.34 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 46 E 8.80 3.89 0.00 2.20 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 2.33 2.48 0.00 47 L 8.31 3.89 0.00 1.59 1.69 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.09 3.93 1.24 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 0.00 0.00 0.00 49 H 7.99 4.23 0.00 3.31 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.46 4.33 0.00 1.67 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.68 7.81 51 G 7.63 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.89 4.43 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 53 L 7.48 4.72 0.00 1.67 1.72 0.57 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.12 0.00 2.09 2.06 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 55 G 9.14 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 0.00 0.00 0.00 0.00 56 V 7.07 3.67 2.38 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 0.79 0.00 0.00 1.36 0.00 0.00 57 R 7.97 4.55 0.00 1.81 1.80 0.00 3.32 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 58 K 8.49 3.86 0.00 1.76 1.75 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.40 7.81 59 A 8.56 4.25 1.46 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 0.00 0.00 60 S 8.33 5.50 0.00 3.94 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 61 W 8.20 4.60 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