NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3735 8.1593 117.3787 63.7714 69.0617 173.0272 6 N 4.7698 7.6870 117.0676 50.8549 38.1769 173.7823 7 S 4.5383 7.6066 108.9121 58.1271 66.2068 175.2320 8 D 5.3324 8.4053 125.8555 52.7154 45.0222 173.6940 9 F 5.2582 7.9914 115.4305 55.6977 41.3502 173.3642 10 V 4.5002 8.9193 118.6494 61.0412 35.0642 174.0559 11 V 4.9501 8.8104 126.7443 61.2532 34.0507 174.2996 12 I 4.9433 8.9122 128.3212 59.4606 40.6250 174.0817 13 K 5.0423 9.3050 129.2550 54.3101 34.4819 175.0060 14 A 4.5003 8.9348 130.2675 52.1088 19.2232 177.4676 15 L 4.7400 8.9866 122.1367 54.6605 42.6956 175.6642 16 E 4.7314 7.6631 115.7584 55.1128 32.6007 174.3785 17 D 4.4005 8.5819 119.7970 55.0326 41.6606 177.2372 18 G 3.8587 8.5462 109.1619 45.5961 0.0000 173.9775 19 V 3.9072 7.4656 119.7686 63.1122 32.8321 174.5930 20 N 5.4598 9.0331 123.9894 51.3921 42.0641 173.4181 21 V 4.7270 8.8741 123.3712 61.1366 34.2034 174.1833 22 I 4.7440 8.8638 128.9433 59.3568 40.3465 174.6702 23 G 4.1894 8.6835 114.3915 44.8535 0.0000 172.3490 24 L 5.4857 8.5125 124.4755 52.6340 44.3578 176.2100 25 T 4.5312 8.6420 114.3904 61.8445 69.3059 174.1873 26 R 4.2478 7.8568 125.9848 56.7035 30.9386 174.9179 27 G 3.7379 8.8593 109.8180 44.0256 0.0000 172.8967 28 A 4.0897 8.6855 121.3816 54.7816 18.5672 178.1136 29 D 4.8099 7.7972 113.6395 53.4757 42.4510 176.0567 30 T 4.7964 8.2870 117.8735 61.9382 71.2722 173.4676 31 R 4.7540 8.8593 122.4093 54.1243 33.6213 174.5098 32 F 5.1306 8.8470 120.0028 58.4291 38.7789 174.7625 33 H 4.9369 8.9798 119.3320 56.4698 30.4030 174.5494 34 H 4.7360 7.7174 117.2636 55.1041 33.2576 171.9217 35 S 4.9575 8.4659 120.0174 56.3803 64.6695 172.2571 36 E 4.5463 9.1334 128.8374 54.2642 31.4112 174.4619 37 K 4.7895 8.6334 128.7706 55.8646 33.4682 175.6247 38 L 5.0215 9.1164 126.9550 53.1582 45.1599 176.0525 39 D 4.9902 9.5113 123.5824 52.3181 43.3843 175.8563 40 K 3.9587 8.9239 121.4179 58.6789 32.1982 177.1355 41 G 3.9952 9.3385 114.8713 45.3271 0.0000 173.3898 42 E 4.2468 8.1110 120.0792 56.2061 30.8128 175.9468 43 V 4.8406 8.3177 122.4524 60.9804 34.2583 174.1611 44 L 4.7100 9.1013 129.8984 53.2941 44.6853 174.8239 45 I 4.9004 8.5134 126.8381 59.7288 38.8615 174.6938 46 A 4.7215 8.7749 129.3795 50.0034 21.6174 175.3960 47 Q 4.7257 8.6568 121.3008 55.3038 30.1293 175.9775 48 F 4.6931 8.4853 120.9642 58.0129 39.9384 175.0235 49 T 4.6908 9.0067 111.4473 60.1917 71.8922 174.0083 50 E 3.8867 8.9027 121.3655 59.0701 29.6650 176.9857 51 H 4.7045 8.2844 113.8173 55.7842 30.2687 173.8994 52 T 5.3419 7.8872 116.9165 61.9276 71.3373 174.3055 53 S 5.0493 9.0891 119.4894 57.9500 65.0270 173.4241 54 A 5.0285 7.9591 121.5449 51.1006 22.6074 175.1617 55 I 4.9899 8.5445 120.8666 59.3277 40.7702 174.6974 56 K 4.5802 9.0001 128.2262 54.4812 34.7683 174.7559 57 V 4.8904 8.3285 126.0039 61.1373 34.2365 174.5771 58 R 4.5702 9.0245 126.2511 55.6328 33.5039 175.9542 59 G 4.0781 8.9977 108.4762 44.2067 0.0000 172.6186 60 K 4.2877 9.0740 120.5183 56.1354 32.7685 175.6277 61 A 5.1496 8.4778 127.8672 50.8369 22.7801 174.0020 62 Y 4.7632 9.1773 121.7112 56.0341 41.0651 174.6428 63 I 5.0626 8.1896 126.8782 59.5197 41.2063 174.2980 64 Q 5.0373 8.9214 125.2058 54.3473 32.0367 174.8627 65 T 4.6198 8.4071 112.6385 59.4883 72.3874 174.4427 66 R 3.7797 8.5703 120.5082 59.7725 29.8225 176.7590 67 H 4.5744 7.8679 112.7048 55.6138 29.8472 174.2770 68 G 3.8296 7.1412 105.7400 44.0251 0.0000 172.5248 69 V 4.8173 8.2076 121.2246 60.9248 34.2525 176.4659 70 I 4.4129 8.2926 119.6802 58.8928 39.8069 172.6277 71 E 4.5838 8.5556 129.8199 57.4336 32.3777 179.7766 72 S 3.6313 7.8679 102.4191 59.6706 59.7102 172.2650 73 E 4.1679 7.9069 125.2596 56.0813 29.4181 175.8148 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 5 T 8.16 4.37 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 6 N 7.69 4.77 0.00 2.88 2.88 0.00 0.00 6.13 6.76 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 7 S 7.61 4.54 0.00 3.84 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 8 D 8.41 5.33 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.99 5.26 0.00 3.03 2.96 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 10 V 8.92 4.50 1.95 0.00 0.00 0.00 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 0.79 0.00 0.00 11 V 8.81 4.95 2.17 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 1.03 0.00 0.00 1.19 0.00 0.00 12 I 8.91 4.94 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.45 0.91 0.00 0.00 13 K 9.31 5.04 0.00 1.84 1.80 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.37 7.81 14 A 8.93 4.50 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.99 4.74 0.00 1.57 1.72 1.00 0.77 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 16 E 7.66 4.73 0.00 1.92 1.90 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 2.19 2.34 0.00 17 D 8.58 4.40 0.00 2.59 2.72 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 0.00 0.00 0.00 18 G 8.55 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 19 V 7.47 3.91 2.08 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 0.84 0.00 0.00 0.98 0.00 0.00 20 N 9.03 5.46 0.00 2.68 2.59 0.00 0.00 6.31 7.30 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 21 V 8.87 4.73 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 0.91 0.00 0.00 0.90 0.00 0.00 22 I 8.86 4.74 1.39 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.45 0.06 0.00 0.00 23 G 8.68 4.19 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 0.00 0.00 0.00 24 L 8.51 5.49 0.00 1.90 1.68 0.75 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.64 4.53 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 1.37 0.00 0.00 26 R 7.86 4.25 0.00 1.91 2.00 0.00 3.22 0.00 0.00 3.08 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.86 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.69 4.09 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 29 D 7.80 4.81 0.00 2.69 2.61 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 0.00 0.00 0.00 0.00 30 T 8.29 4.80 4.28 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 1.30 0.00 0.00 31 R 8.86 4.75 0.00 1.84 1.96 0.00 2.81 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 32 F 8.85 5.13 0.00 2.89 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 33 H 8.98 4.94 0.00 3.14 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.72 4.74 0.00 3.33 3.12 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.47 4.96 0.00 3.81 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.13 4.55 0.00 2.12 1.77 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 2.22 2.27 0.00 37 K 8.63 4.79 0.00 1.79 1.68 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.46 7.81 38 L 9.12 5.02 0.00 1.54 1.50 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.51 4.99 0.00 2.54 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.92 3.96 0.00 1.80 1.76 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 41 G 9.34 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.11 4.25 0.00 2.06 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 2.35 0.00 43 V 8.32 4.84 2.09 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 0.81 0.00 0.00 0.94 0.00 0.00 44 L 9.10 4.71 0.00 1.73 1.47 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.51 4.90 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.75 0.00 0.00 46 A 8.77 4.72 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.66 4.73 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 48 F 8.49 4.69 0.00 3.03 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 49 T 9.01 4.69 4.30 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 1.27 0.00 0.00 50 E 8.90 3.89 0.00 1.94 2.02 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 2.11 2.29 0.00 51 H 8.28 4.70 0.00 3.29 3.24 0.00 5.80 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 52 T 7.89 5.34 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 53 S 9.09 5.05 0.00 3.84 4.08 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 A 7.96 5.03 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 55 I 8.54 4.99 1.79 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.62 0.85 0.00 0.00 56 K 9.00 4.58 0.00 1.63 1.34 0.00 1.58 0.00 0.00 1.36 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.23 1.30 7.81 57 V 8.33 4.89 2.05 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 0.86 0.00 0.00 0.89 0.00 0.00 58 R 9.02 4.57 0.00 1.76 1.75 0.00 3.16 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 59 G 9.00 4.08 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 0.00 0.00 0.00 60 K 9.07 4.29 0.00 1.87 1.72 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.49 7.81 61 A 8.48 5.15 1.23 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 0.00 0.00 62 Y 9.18 4.76 0.00 3.06 2.81 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 63 I 8.19 5.06 1.74 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.51 0.88 0.00 0.00 64 Q 8.92 5.04 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.53 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 65 T 8.41 4.62 4.12 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 1.15 0.00 0.00 66 R 8.57 3.78 0.00 1.75 1.83 0.00 3.21 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 67 H 7.87 4.57 0.00 3.17 3.28 0.00 5.69 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 68 G 7.14 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 0.00 0.00 0.00 69 V 8.21 4.82 2.02 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 0.48 0.00 0.00 0.88 0.00 0.00 70 I 8.29 4.41 1.80 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 1.04 0.48 0.87 0.00 0.00 71 E 8.56 4.58 0.00 2.12 1.78 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 2.32 2.67 0.00 72 S 7.87 3.63 0.00 3.97 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 73 E 7.91 4.17 0.00 2.24 1.83 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 2.27 2.36 0.00