NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3564 8.1744 110.9434 61.2005 70.6575 173.5134 6 N 4.7928 7.8473 120.7012 53.0661 39.3656 173.0934 7 S 4.5302 8.8579 113.5430 57.5529 65.0915 173.3607 8 D 4.8169 8.5167 121.3288 54.8423 41.8184 175.4630 9 F 5.3211 7.8855 114.1189 55.5522 41.5008 173.8740 10 V 4.5904 8.7635 112.2521 59.5540 35.2383 174.8360 11 V 4.8419 8.5583 123.4954 61.3096 33.9912 174.4312 12 I 5.0150 9.0507 128.3906 59.3258 40.8883 174.1340 13 K 5.0832 8.9151 128.0210 54.1404 34.6197 175.0568 14 A 4.3737 8.7478 130.4151 52.4621 19.1701 177.3698 15 L 4.7471 8.9652 121.9145 54.4509 42.5016 175.9263 16 E 4.6577 7.6305 115.5412 55.1560 32.0645 174.4969 17 D 4.5049 8.4289 119.4152 55.4161 41.4103 176.6696 18 G 3.8803 8.0284 105.5476 46.2296 0.0000 174.1459 19 V 3.8909 7.5013 119.6829 62.8300 32.9131 174.6103 20 N 5.2771 9.1623 124.9863 51.5719 41.2462 173.6285 21 V 4.5549 8.6783 125.3234 61.3797 33.4870 174.3201 22 I 4.4758 8.6857 130.1750 59.3566 39.4512 175.1257 23 G 4.0400 8.8377 115.5883 45.3731 0.0000 172.6871 24 L 5.2582 8.9145 126.7917 53.6477 43.6518 176.5312 25 T 4.5174 8.7930 114.2783 61.6439 69.2733 174.2906 26 R 4.2481 8.0181 126.2667 57.2127 30.8613 174.8747 27 G 3.7666 8.8106 109.1993 44.1655 0.0000 172.9879 28 A 4.0577 8.6972 121.1298 54.5170 18.6492 177.7672 29 D 4.7809 7.8502 114.2097 53.2817 42.4517 176.2878 30 T 4.5092 8.3070 122.8391 61.3586 68.8724 172.7216 31 R 4.8128 8.7394 122.6466 53.7180 33.8718 174.3475 32 F 5.2513 8.7154 118.0681 57.8550 38.9557 175.5892 33 H 4.9807 9.0460 118.5403 56.4549 30.5682 174.1261 34 H 4.8048 7.6000 117.2528 54.9145 33.3638 172.0970 35 S 4.7861 8.1243 118.9398 56.4189 64.5795 172.4403 36 E 4.4257 8.9537 129.8284 54.9120 30.9416 174.7890 37 K 4.8277 8.6021 126.8578 55.4774 33.5088 175.9822 38 L 4.9349 9.1225 125.3240 53.0618 44.7006 176.1806 39 D 4.9746 9.0303 123.2083 52.6117 43.1031 175.9328 40 K 3.9585 8.7983 121.8707 58.5858 32.3115 176.8146 41 G 4.0488 9.0283 115.5166 45.2202 0.0000 173.6162 42 E 4.2121 8.1211 119.4988 56.3486 30.7301 176.0895 43 V 4.9329 8.3095 122.3222 61.0008 34.2419 174.2509 44 L 4.7778 9.1658 129.5998 53.2302 44.9475 174.8076 45 I 5.0586 8.4431 126.1375 59.5201 39.5321 174.7849 46 A 4.6584 9.0778 128.9298 50.2112 22.1813 175.4738 47 Q 4.7794 8.6715 121.1082 55.1802 30.3049 175.7532 48 F 4.6875 8.5460 120.3629 57.8984 38.8834 175.3526 49 T 4.6882 8.8731 111.2013 60.1525 71.9448 173.7944 50 E 4.0293 8.9857 121.1460 59.5996 29.5175 177.5303 51 H 4.5969 7.7618 111.6204 56.4149 29.8494 174.4180 52 T 5.5203 8.3152 116.1999 60.8008 71.2053 174.4353 53 S 4.9435 8.9913 119.5626 57.9990 64.9516 173.2298 54 A 5.0176 7.8918 121.2608 51.1882 22.5722 175.1962 55 I 4.9571 8.5827 120.9174 59.3803 40.5069 174.7161 56 K 4.5840 8.9046 128.4030 54.5292 34.6598 174.7253 57 V 4.8158 8.3806 126.5164 61.2071 33.5596 174.5414 58 R 4.5551 9.3214 127.4081 55.6368 32.8567 176.5677 59 G 4.1306 8.9811 108.6470 44.2486 0.0000 172.4482 60 K 4.6248 9.5238 120.4226 55.4944 32.9707 175.5912 61 A 5.1147 8.6061 127.1960 50.8410 23.4685 173.6404 62 Y 5.0885 9.1763 121.5762 55.9564 41.3363 174.6160 63 I 4.9541 8.3964 126.9145 59.4889 41.0507 174.2685 64 Q 5.0223 9.0010 125.8420 54.3190 31.9008 174.8925 65 T 4.8118 8.5902 112.9041 59.4658 72.4392 174.4079 66 R 3.7118 8.5772 120.6165 59.6285 29.7475 176.4463 67 H 4.7009 8.6192 112.2323 55.1381 29.3503 174.4343 68 G 3.7492 6.7353 106.5388 44.0758 0.0000 173.0239 69 V 4.7477 7.8725 112.5129 59.8734 34.6128 175.2655 70 I 4.5074 8.0432 121.8304 60.0118 41.8913 172.8621 71 E 5.2922 8.6423 126.7848 54.5200 31.6835 176.1131 72 S 4.5747 8.6738 118.9703 58.1333 64.9714 172.8772 73 E 4.8153 8.7095 119.6003 54.4910 33.0530 176.2823 74 G 3.7191 8.6219 110.5252 45.7435 0.0000 172.9841 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 8.17 4.36 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 7.85 4.79 0.00 2.79 2.84 0.00 0.00 7.11 6.75 0.00 0.00 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 8.86 4.53 0.00 4.12 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 8 D 8.52 4.82 0.00 2.75 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 5.32 0.00 2.95 2.94 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 10 V 8.76 4.59 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 0.61 0.00 0.00 0.87 0.00 0.00 11 V 8.56 4.84 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.16 0.00 0.00 12 I 9.05 5.02 1.87 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 1.08 0.47 0.91 0.00 0.00 13 K 8.92 5.08 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.38 7.81 14 A 8.75 4.37 1.35 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 0.00 0.00 0.00 15 L 8.97 4.75 0.00 1.60 1.71 1.01 0.83 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 7.63 4.66 0.00 2.03 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 2.36 2.32 0.00 17 D 8.43 4.50 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 3.88 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 0.00 0.00 0.00 19 V 7.50 3.89 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 0.98 0.00 0.00 1.01 0.00 0.00 20 N 9.16 5.28 0.00 2.60 2.61 0.00 0.00 6.33 8.53 0.00 0.00 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 8.68 4.55 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 0.98 0.00 0.00 0.89 0.00 0.00 22 I 8.69 4.48 1.47 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.22 -0.42 0.00 0.00 23 G 8.84 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.91 5.26 0.00 1.85 1.70 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.79 4.52 4.32 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 1.34 0.00 0.00 26 R 8.02 4.25 0.00 1.88 1.96 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 1.65 1.44 0.00 27 G 8.81 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.70 4.06 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 7.85 4.78 0.00 2.64 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 30 T 8.31 4.51 4.27 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 1.27 0.00 0.00 31 R 8.74 4.81 0.00 1.83 2.01 0.00 2.79 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 32 F 8.72 5.25 0.00 2.87 2.93 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 33 H 9.05 4.98 0.00 3.14 3.50 0.00 5.78 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 7.60 4.80 0.00 3.28 3.07 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.12 4.79 0.00 3.65 3.58 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 36 E 8.95 4.43 0.00 2.15 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 2.25 2.32 0.00 37 K 8.60 4.83 0.00 1.64 1.72 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.49 7.81 38 L 9.12 4.93 0.00 1.51 1.53 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.03 4.97 0.00 2.61 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 40 K 8.80 3.96 0.00 1.80 1.75 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.54 7.81 41 G 9.03 4.05 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 0.00 0.00 0.00 42 E 8.12 4.21 0.00 2.11 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 2.26 0.00 43 V 8.31 4.93 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 0.85 0.00 0.00 0.96 0.00 0.00 44 L 9.17 4.78 0.00 1.71 1.44 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.44 5.06 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.77 0.60 0.00 0.00 46 A 9.08 4.66 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.67 4.78 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 48 F 8.55 4.69 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.69 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 1.26 0.00 0.00 50 E 8.99 4.03 0.00 1.91 1.94 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 2.10 2.29 0.00 51 H 7.76 4.60 0.00 3.20 3.14 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 8.32 5.52 4.39 0.00 0.00 0.00 0.00 0.00 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 53 S 8.99 4.94 0.00 3.82 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 54 A 7.89 5.02 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 55 I 8.58 4.96 1.87 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.77 0.84 0.00 0.00 56 K 8.90 4.58 0.00 1.83 1.56 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.35 7.81 57 V 8.38 4.82 2.06 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 0.86 0.00 0.00 0.90 0.00 0.00 58 R 9.32 4.56 0.00 1.72 1.78 0.00 3.16 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 59 G 8.98 4.13 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 0.00 60 K 9.52 4.62 0.00 1.94 1.72 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.26 7.81 61 A 8.61 5.11 1.26 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 0.00 0.00 0.00 62 Y 9.18 5.09 0.00 3.05 2.79 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 63 I 8.40 4.95 1.83 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 1.18 0.49 0.82 0.00 0.00 64 Q 9.00 5.02 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.16 2.07 0.00 65 T 8.59 4.81 4.13 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 1.16 0.00 0.00 66 R 8.58 3.71 0.00 1.57 1.67 0.00 3.44 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 67 H 8.62 4.70 0.00 3.17 3.26 0.00 5.70 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 6.74 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 4.75 1.82 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 0.69 0.00 0.00 0.98 0.00 0.00 70 I 8.04 4.51 1.82 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 1.21 0.71 0.84 0.00 0.00 71 E 8.64 5.29 0.00 1.90 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 2.41 2.37 0.00 72 S 8.67 4.57 0.00 3.93 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 8.71 4.82 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 74 G 8.62 3.72 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 0.00 0.00 0.00