NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.1442 8.1801 120.9924 57.1445 41.5554 177.3230 2 A 3.4592 7.5815 121.2284 53.2887 15.8465 175.4482 3 A 4.5533 7.5322 123.5235 49.6243 19.5790 174.9736 4 V 4.6069 7.3879 119.9848 60.3700 35.1245 175.1931 5 S 4.3814 7.9528 111.3133 58.1356 64.3854 176.3508 6 V 4.2796 7.6848 115.0336 59.3038 33.3925 175.5208 7 D 4.4666 8.3651 121.8418 55.1537 41.3748 177.8361 8 C 5.4376 8.8346 122.3005 57.9362 42.0150 174.1453 9 S 4.8591 8.1366 113.6768 57.6375 63.3082 175.1198 10 E 4.6530 8.1389 114.4840 58.2770 30.4278 173.9048 11 Y 4.7838 7.9921 117.3875 55.9556 40.2232 173.2177 12 P 4.5741 0.0000 0.0000 62.5943 32.2288 175.9586 13 K 4.1651 6.0786 119.3046 55.0534 34.2337 176.4767 14 D 4.4872 7.9162 121.6316 52.1332 40.2912 174.1529 15 A 4.2109 6.8796 121.0894 52.8875 22.0097 175.0288 16 C 4.8691 8.4431 117.8813 56.1399 46.5237 172.3533 17 T 4.8269 8.1811 109.6846 59.6284 70.5288 174.2106 18 L 4.1840 8.3856 123.2237 57.8819 41.2537 177.2789 19 E 4.1976 7.9988 117.9064 56.3757 30.0571 174.9389 20 Y 4.8749 8.4348 121.7211 56.2041 40.9206 175.5099 21 R 4.7800 9.9426 126.5675 54.0381 33.8188 172.2966 22 P 5.7204 0.0000 0.0000 62.1973 32.8755 175.4817 23 L 5.1483 8.7238 121.8537 52.9844 46.7228 175.8282 24 C 5.1304 8.8168 119.4974 54.8755 44.0423 173.9250 25 G 4.4650 9.3298 114.8176 45.7425 0.0000 173.8367 26 S 4.5133 9.0417 114.1370 60.2153 61.1646 174.2959 27 D 4.6803 8.0883 119.2705 53.8572 40.5459 176.0270 28 N 4.0863 7.8794 115.6596 54.5049 37.9114 174.2918 29 K 4.1135 7.2877 115.2551 55.0915 32.7647 176.1187 30 T 4.7168 8.0681 122.6618 63.1642 69.4101 174.1445 31 Y 4.7500 9.1251 123.6126 56.2969 41.4478 176.9745 32 G 3.7781 8.9397 109.1144 47.7332 0.0000 174.3880 33 N 5.6177 7.6228 116.2819 49.6554 44.2238 175.2238 34 K 3.9773 8.6214 122.3655 58.6773 32.2340 178.0230 35 C 4.9925 7.9445 115.8081 58.7894 38.7040 175.4347 36 N 4.3260 8.0923 119.2858 55.5515 38.1769 177.0369 37 F 2.0000 7.8497 121.9693 60.7189 39.2665 176.3704 38 C 3.9165 8.1620 116.4620 60.0490 40.8819 175.6645 39 N 4.2492 7.5784 118.0013 56.7232 38.3474 176.7042 40 A 3.9420 7.5041 122.2814 54.8104 18.3292 179.6180 41 V 3.2729 7.5178 117.1711 66.2201 31.5138 178.5255 42 V 3.4711 8.0159 112.3387 64.7254 31.2372 178.5927 43 E 4.0423 8.1482 117.1956 58.5581 29.6119 177.6969 44 S 4.5984 8.1745 113.1127 58.3789 63.4771 173.9189 45 N 4.0967 8.4425 115.0276 53.6716 37.8816 173.6526 46 G 3.8877 8.7551 103.3392 46.6012 0.0000 175.3547 47 T 4.2518 8.0067 111.8736 61.9723 69.9649 175.1834 48 L 4.0102 7.7796 124.3106 55.1025 42.7910 175.6487 49 T 4.8297 8.1794 114.8722 59.6055 72.4189 172.5527 50 L 4.7378 8.5834 125.5660 55.0445 42.1807 176.3712 51 S 4.4302 9.3921 122.8498 61.3633 63.7151 173.0344 52 H 4.7822 7.6052 112.4995 55.6708 31.3602 172.8792 53 F 4.5099 9.0837 117.9748 56.1544 40.6162 174.0036 54 G 4.0290 8.8281 115.9734 44.1898 0.0000 173.6928 55 K 3.8687 8.5697 118.3045 56.2906 32.7662 177.4757 56 C 4.4713 8.0858 121.2932 57.2632 44.4579 173.4002 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 L 8.18 4.14 0.00 1.78 1.80 0.93 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 2 A 7.58 3.46 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 3 A 7.53 4.55 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 4 V 7.39 4.61 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 1.04 0.00 0.00 1.13 0.00 0.00 5 S 7.95 4.38 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 6 V 7.68 4.28 1.97 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 0.61 0.00 0.00 0.36 0.00 0.00 7 D 8.37 4.47 0.00 2.64 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 8 C 8.83 5.44 0.00 2.96 2.89 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 9 S 8.14 4.86 0.00 4.02 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 10 E 8.14 4.65 0.00 2.12 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 0.00 2.39 2.34 0.00 11 Y 7.99 4.78 0.00 3.03 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 12 P 0.00 4.57 0.00 2.08 2.13 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 13 K 6.08 4.17 0.00 0.91 1.48 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.07 7.81 14 D 7.92 4.49 0.00 2.53 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.88 4.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.44 4.87 0.00 2.90 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 17 T 8.18 4.83 4.26 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 1.25 0.00 0.00 18 L 8.39 4.18 0.00 1.78 1.84 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.00 4.20 0.00 2.00 1.99 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 2.35 2.40 0.00 20 Y 8.43 4.87 0.00 2.99 2.74 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 21 R 9.94 4.78 0.00 1.78 1.96 0.00 3.36 0.00 0.00 3.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 22 P 0.00 5.72 0.00 2.32 2.36 0.00 3.92 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.83 0.00 23 L 8.72 5.15 0.00 1.75 1.28 1.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 C 8.82 5.13 0.00 2.84 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 25 G 9.33 4.47 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 0.00 0.00 0.00 26 S 9.04 4.51 0.00 3.84 3.93 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 0.00 0.00 0.00 27 D 8.09 4.68 0.00 2.79 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.88 4.09 0.00 2.86 2.86 0.00 0.00 7.06 6.83 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 29 K 7.29 4.11 0.00 1.64 1.31 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.07 1.26 7.81 30 T 8.07 4.72 4.15 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 0.00 0.00 0.00 1.27 0.00 0.00 31 Y 9.13 4.75 0.00 2.98 2.87 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 32 G 8.94 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 33 N 7.62 5.62 0.00 2.69 2.67 0.00 0.00 7.24 7.12 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 34 K 8.62 3.98 0.00 1.63 1.77 0.00 1.75 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.36 7.81 35 C 7.94 4.99 0.00 3.37 3.42 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 36 N 8.09 4.33 0.00 2.98 3.16 0.00 0.00 6.73 8.18 0.00 0.00 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 7.85 2.00 0.00 2.37 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 38 C 8.16 3.92 0.00 1.74 1.18 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.58 4.25 0.00 3.14 2.97 0.00 0.00 7.48 7.33 0.00 0.00 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 A 7.50 3.94 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 41 V 7.52 3.27 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 1.06 0.00 0.00 0.63 0.00 0.00 42 V 8.02 3.47 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 1.03 0.00 0.00 1.11 0.00 0.00 43 E 8.15 4.04 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 44 S 8.17 4.60 0.00 4.03 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 45 N 8.44 4.10 0.00 2.78 2.82 0.00 0.00 7.02 8.47 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 46 G 8.76 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 0.00 0.00 0.00 47 T 8.01 4.25 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 1.23 0.00 0.00 48 L 7.78 4.01 0.00 1.48 1.43 0.86 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.18 4.83 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 50 L 8.58 4.74 0.00 1.46 1.46 -0.26 0.23 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 51 S 9.39 4.43 0.00 4.21 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 52 H 7.61 4.78 0.00 3.31 3.40 0.00 5.69 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 9.08 4.51 0.00 3.06 2.99 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 54 G 8.83 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.57 3.87 0.00 1.78 1.84 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.53 7.81 56 C 8.09 4.47 0.00 3.00 3.02 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