NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9468 8.3393 109.7363 45.0985 0.0000 175.0381 3 S 4.0881 8.4619 119.5085 57.1281 64.9784 169.6363 4 V 3.5366 9.3054 124.4047 66.5337 31.4971 179.2200 5 E 3.9346 8.2694 117.5008 59.7568 29.2902 179.0908 6 D 4.3148 7.8475 117.9512 57.6015 40.9837 179.1396 7 R 3.9106 8.1536 118.4555 59.1095 29.9392 179.2889 8 V 3.6882 7.7831 118.1350 65.8787 31.6803 178.2971 9 T 4.1774 7.7985 116.8606 66.1389 68.2331 176.0730 10 Q 3.9175 8.1990 121.4704 59.4869 28.9678 178.2917 11 L 3.9021 7.9856 119.5857 58.3850 41.6002 179.7283 12 E 3.9501 8.2395 118.1393 59.0430 29.3541 179.4691 13 R 3.8856 7.7963 118.4792 59.4559 30.2774 178.4386 14 I 3.5829 7.8981 119.9136 64.5669 37.2141 178.3201 15 S 4.0572 8.2823 114.0319 61.4693 62.2268 176.0569 16 N 4.3574 8.2678 119.1136 56.0644 38.2822 177.1852 17 A 4.0266 7.9424 122.2249 55.4664 18.4634 179.4727 18 H 4.2425 8.3262 114.6535 59.2130 28.9362 178.1422 19 S 4.2044 8.0076 116.6984 61.6848 62.6104 176.9836 20 Q 3.9539 7.9962 120.1303 58.8246 28.5059 178.2650 21 L 3.9142 7.9688 121.2755 58.2796 42.1154 178.7072 22 L 3.9751 8.3943 119.1235 58.4772 41.5945 179.8450 23 T 3.8922 7.8111 114.7971 66.7240 68.3806 176.8453 24 Q 4.0045 8.1087 120.0106 58.9929 28.6813 178.8089 25 L 4.0599 8.4090 120.4563 57.5036 41.4919 179.4052 26 Q 3.9657 8.0596 118.2835 59.0435 28.6300 178.4845 27 Q 3.9554 7.9314 120.2232 59.6088 29.0400 178.6825 28 Q 3.9686 8.0863 118.6623 58.7927 28.7630 178.5771 29 L 3.9303 8.2464 121.6368 58.3955 42.1555 179.1129 30 S 4.2762 8.3069 115.2104 61.8101 62.6882 176.3688 31 D 4.3768 8.3665 121.6690 57.6653 40.5918 178.7731 32 N 4.3367 8.3176 116.7701 56.2816 38.4355 177.5342 33 Q 3.9178 8.5773 119.7532 59.1556 28.8909 178.6290 34 S 4.1210 8.4810 116.4327 62.1341 62.9525 176.8415 35 D 4.3819 8.4542 121.4719 57.2327 40.5071 178.9305 36 I 3.7029 7.7615 120.3569 64.4455 37.1426 178.1528 37 D 4.2906 8.2277 119.6893 57.3935 40.7477 178.4370 38 S 4.0863 7.9273 113.5920 61.7745 62.3083 176.4193 39 L 3.9851 8.0136 121.1498 57.6839 41.3207 179.4197 40 R 4.0192 8.5949 118.6036 59.4297 30.1006 178.8330 41 G 3.8190 8.1145 105.0813 48.3023 0.0000 175.6126 42 Q 4.0092 7.9862 120.7028 58.4402 28.6824 178.6619 43 I 3.7139 7.9112 119.6986 64.1819 37.9818 177.9218 44 Q 4.0285 8.2887 118.9844 58.9340 28.4482 178.7382 45 E 3.9138 8.3180 119.5125 59.4586 29.5151 178.6876 46 N 4.2795 8.4779 116.9302 56.7999 38.6495 177.0328 47 Q 3.9730 8.3289 120.4643 59.3890 29.2512 177.7602 48 Y 4.0445 8.5257 120.8850 60.9830 38.8596 178.2766 49 Q 4.1017 8.7805 119.3918 58.6999 28.8038 178.2056 50 L 3.9439 8.6143 121.7949 58.4013 42.1194 178.7255 51 N 4.2767 8.5024 116.6394 56.6068 38.4523 177.3740 52 Q 3.9190 7.7558 118.8254 58.8148 28.7162 179.0406 53 V 3.5843 7.7692 119.4657 65.7707 31.2225 178.3118 54 V 3.5391 7.7635 118.0999 66.0421 31.2996 177.6980 55 E 3.9786 8.0931 119.0548 59.1027 29.5611 178.5390 56 R 3.8934 8.1314 119.1638 59.5245 30.1211 178.4809 57 Q 4.0325 8.1581 117.3589 59.1275 28.5305 178.7522 58 K 3.9552 7.7267 119.0886 59.5104 32.1540 179.3125 59 Q 4.0463 7.8481 118.3144 58.9266 28.4472 179.0792 60 I 3.7729 7.5968 120.6813 64.1720 37.0668 178.3746 61 L 3.9755 8.0135 119.8577 57.6962 41.2884 179.4309 62 L 4.1166 7.8049 118.7304 58.1611 41.4033 179.6825 63 Q 4.0124 7.9066 116.2981 59.0735 28.7757 178.6861 64 I 3.8515 8.1472 121.1805 64.3995 36.9593 178.0967 65 D 4.3792 8.3871 120.1801 57.6230 40.4604 179.0202 66 S 4.2264 7.6755 114.0623 60.8650 62.9328 176.1556 67 L 4.2381 7.5767 121.0978 56.4110 41.4057 177.0811 68 S 4.2144 7.7007 118.5483 58.3782 63.1915 173.6468 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 G 8.34 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.46 4.09 0.00 4.14 4.01 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 4 V 9.31 3.54 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 1.06 0.00 0.00 0.93 0.00 0.00 5 E 8.27 3.93 0.00 2.04 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 2.40 2.42 0.00 6 D 7.85 4.31 0.00 2.86 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 3.91 0.00 1.85 1.98 0.00 3.11 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 8 V 7.78 3.69 2.27 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 1.03 0.00 0.00 0.95 0.00 0.00 9 T 7.80 4.18 4.38 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 1.21 0.00 0.00 10 Q 8.20 3.92 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 11 L 7.99 3.90 0.00 1.95 1.73 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.24 3.95 0.00 2.24 1.98 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 2.32 2.41 0.00 13 R 7.80 3.89 0.00 1.90 2.19 0.00 3.23 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 14 I 7.90 3.58 1.80 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 1.37 0.51 0.71 0.00 0.00 15 S 8.28 4.06 0.00 3.93 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 16 N 8.27 4.36 0.00 2.95 2.84 0.00 0.00 6.84 8.27 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 17 A 7.94 4.03 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 18 H 8.33 4.24 0.00 3.35 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.01 4.20 0.00 4.05 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 20 Q 8.00 3.95 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 21 L 7.97 3.91 0.00 1.87 1.81 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.39 3.98 0.00 1.91 1.73 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.81 3.89 4.38 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 1.21 0.00 0.00 24 Q 8.11 4.00 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 25 L 8.41 4.06 0.00 1.65 1.71 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.06 3.97 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 27 Q 7.93 3.96 0.00 2.29 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 28 Q 8.09 3.97 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 29 L 8.25 3.93 0.00 1.78 1.91 0.92 0.85 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 30 S 8.31 4.28 0.00 3.97 3.90 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 31 D 8.37 4.38 0.00 2.83 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 32 N 8.32 4.34 0.00 2.87 2.86 0.00 0.00 7.08 7.01 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 33 Q 8.58 3.92 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 34 S 8.48 4.12 0.00 3.80 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 35 D 8.45 4.38 0.00 2.66 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.76 3.70 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.89 0.91 0.00 0.00 37 D 8.23 4.29 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.93 4.09 0.00 3.90 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 39 L 8.01 3.99 0.00 1.91 1.70 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.59 4.02 0.00 1.97 2.00 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 41 G 8.11 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 42 Q 7.99 4.01 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 43 I 7.91 3.71 1.88 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 1.53 1.46 1.02 0.00 0.00 44 Q 8.29 4.03 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 45 E 8.32 3.91 0.00 2.11 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 2.44 0.00 46 N 8.48 4.28 0.00 2.99 2.91 0.00 0.00 6.71 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 47 Q 8.33 3.97 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 48 Y 8.53 4.04 0.00 3.15 3.14 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 0.00 0.00 0.00 0.00 49 Q 8.78 4.10 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.55 2.71 0.00 50 L 8.61 3.94 0.00 1.82 1.82 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.50 4.28 0.00 2.71 2.76 0.00 0.00 7.07 6.93 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 52 Q 7.76 3.92 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 53 V 7.77 3.58 2.23 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 0.99 0.00 0.00 0.93 0.00 0.00 54 V 7.76 3.54 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 0.92 0.00 0.00 0.92 0.00 0.00 55 E 8.09 3.98 0.00 2.10 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 2.27 2.33 0.00 56 R 8.13 3.89 0.00 2.15 2.11 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 57 Q 8.16 4.03 0.00 2.37 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.66 0.00 58 K 7.73 3.96 0.00 2.02 1.89 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.47 7.81 59 Q 7.85 4.05 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 60 I 7.60 3.77 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.79 0.91 0.00 0.00 61 L 8.01 3.98 0.00 1.86 1.71 1.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 62 L 7.80 4.12 0.00 1.87 1.72 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.91 4.01 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 64 I 8.15 3.85 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.99 0.91 0.00 0.00 65 D 8.39 4.38 0.00 2.85 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 66 S 7.68 4.23 0.00 3.81 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 67 L 7.58 4.24 0.00 1.72 1.73 0.92 0.79 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 68 S 7.70 4.21 0.00 3.86 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