NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.9018 8.3544 109.7367 44.6208 0.0000 173.7266 1 Q 3.8012 8.0658 121.4281 54.3992 29.3808 174.1362 2 R 4.6271 8.3260 121.0994 53.6891 32.9409 175.2778 3 R 3.9344 8.3676 118.8434 56.5177 30.4847 176.5849 4 S 4.2432 8.4523 120.7580 58.1926 63.4917 174.4523 5 R 3.9183 8.4976 123.0260 56.9485 30.2410 176.8037 6 T 3.9361 8.3064 119.7216 63.4833 69.2034 173.9120 7 T 4.3463 7.9710 121.8877 61.7286 70.2896 173.9810 8 F 4.9245 8.3622 125.3326 56.2320 40.7376 176.5879 9 T 4.1943 8.6602 115.5118 61.3436 70.8991 175.7134 10 A 4.0350 8.5388 123.8597 55.5422 18.2590 180.0581 11 E 3.9613 8.0852 116.6701 59.5001 29.6184 179.3744 12 Q 3.9416 7.9397 118.1001 58.7989 28.7752 178.4756 13 L 3.6220 7.9627 119.9955 57.4985 41.4908 179.4203 14 E 3.8812 7.8597 118.2629 59.5758 29.4932 179.0495 15 E 3.8906 7.7826 118.3052 59.5205 29.4886 179.7189 16 L 3.5589 7.4523 118.7147 57.6800 41.5576 179.4438 17 E 4.2095 8.2308 118.8311 59.1030 29.0073 179.4216 18 R 3.9217 8.1225 119.0611 59.3845 30.1454 178.4750 19 A 3.9820 7.9990 120.6800 55.1430 18.1872 179.4025 20 F 4.9000 8.1163 119.8433 60.7820 39.4914 176.8187 21 E 4.0641 8.0908 118.0830 58.7642 29.4387 178.3241 22 R 4.0998 7.3091 117.9100 58.1046 30.9107 176.3575 23 T 4.4131 7.6265 110.7427 61.4312 70.6153 173.5683 24 H 4.1993 8.5704 124.3095 57.3809 29.6294 175.3013 25 Y 4.7528 7.4208 116.1083 55.1862 38.0021 173.1484 26 P 4.2631 0.0000 0.0000 62.2533 32.6087 177.7175 27 D 4.6258 8.3707 121.4907 52.7465 41.8718 177.0674 28 I 3.5410 8.0242 118.3119 64.3260 37.7549 177.2056 29 Y 4.1669 7.6382 117.1537 61.3996 37.8130 178.4564 30 T 3.9424 8.6969 117.0784 66.6997 68.5632 177.1895 31 R 3.8976 8.1397 120.1208 59.1388 30.0743 179.0420 32 E 3.9784 8.2983 118.4592 59.5627 29.5397 179.3068 33 E 4.0601 8.2280 118.5213 59.0281 29.5655 179.1297 34 L 4.0094 8.0720 120.5421 57.7964 42.1183 178.6810 35 A 4.0179 8.0875 120.9412 55.0421 18.1996 179.4830 36 Q 3.8527 7.9411 117.8638 59.5769 29.0407 178.4406 37 R 3.9246 7.8738 117.3676 58.7681 30.2117 177.9569 38 A 4.3790 7.6805 117.1924 50.6395 20.2645 176.5633 39 K 3.7758 7.6251 115.5182 57.8066 30.0823 174.5124 40 L 4.8998 8.0701 116.8411 52.5155 45.4858 177.7444 41 T 4.2447 8.0851 110.4338 61.4863 71.0415 175.3548 42 E 4.0036 8.7376 122.1993 59.1758 29.7005 179.0822 43 A 4.0272 7.9554 120.7959 55.1521 18.5623 179.4192 44 R 4.0261 7.9824 117.1074 59.4032 30.2249 178.9865 45 V 3.7514 7.7243 117.8996 65.9818 31.6755 177.8030 46 Q 4.0676 8.3697 119.4296 59.2723 28.9131 178.4295 47 V 3.6810 8.0558 119.3045 65.7784 31.6165 177.7011 48 W 4.0705 8.5706 128.1722 60.6181 30.4870 177.9924 49 F 3.8369 8.6060 117.6022 60.1795 38.3915 177.7166 50 S 4.0738 8.0549 112.4771 61.5956 62.3336 176.0798 51 N 4.2841 7.9876 119.0067 55.8702 38.0550 177.4883 52 R 3.1568 7.1222 120.3704 58.8282 29.9468 178.6992 53 R 4.0363 7.7325 117.7943 59.0180 30.1489 178.8342 54 A 4.0058 7.7159 120.1836 55.2742 18.2021 179.7372 55 R 3.8252 7.4683 115.3920 59.0470 30.1849 178.2178 56 W 4.3336 7.8888 128.4715 60.3211 30.5606 178.2074 57 R 3.9238 8.1070 119.1546 59.1008 29.6667 179.3666 58 K 4.1120 7.7975 122.7214 59.4563 31.7387 181.7928 59 Q 4.3588 7.2877 120.2479 56.2925 28.6024 177.2426 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 0 G 8.35 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 0.00 0.00 0.00 1 Q 8.07 3.80 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 2 R 8.33 4.63 0.00 1.94 1.89 0.00 3.11 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 3 R 8.37 3.93 0.00 1.79 1.89 0.00 3.25 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 4 S 8.45 4.24 0.00 3.88 3.76 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 0.00 0.00 0.00 0.00 5 R 8.50 3.92 0.00 1.77 1.88 0.00 3.21 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 6 T 8.31 3.94 3.87 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 0.56 0.00 0.00 7 T 7.97 4.35 4.14 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 1.18 0.00 0.00 8 F 8.36 4.92 0.00 3.08 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 T 8.66 4.19 4.40 0.00 0.00 0.00 0.00 0.00 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 10 A 8.54 4.04 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 11 E 8.09 3.96 0.00 2.06 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 2.39 2.45 0.00 12 Q 7.94 3.94 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 13 L 7.96 3.62 0.00 1.84 1.67 1.00 0.58 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 14 E 7.86 3.88 0.00 2.23 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 2.31 2.53 0.00 15 E 7.78 3.89 0.00 1.95 1.93 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 2.28 2.46 0.00 16 L 7.45 3.56 0.00 0.47 0.13 -0.66 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.23 4.21 0.00 1.99 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 0.00 2.50 2.50 0.00 18 R 8.12 3.92 0.00 1.94 2.07 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 19 A 8.00 3.98 1.70 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 0.00 0.00 20 F 8.12 4.90 0.00 3.01 3.26 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 21 E 8.09 4.06 0.00 2.20 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 0.00 2.34 2.35 0.00 22 R 7.31 4.10 0.00 1.91 2.15 0.00 3.37 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 23 T 7.63 4.41 4.23 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 1.23 0.00 0.00 24 H 8.57 4.20 0.00 2.87 2.83 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 7.42 4.75 0.00 2.84 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 26 P 0.00 4.26 0.00 1.88 1.76 0.00 3.53 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.44 0.00 27 D 8.37 4.63 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 28 I 8.02 3.54 1.68 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.98 0.24 0.00 0.00 29 Y 7.64 4.17 0.00 3.26 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 30 T 8.70 3.94 4.33 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 0.00 0.00 0.00 1.19 0.00 0.00 31 R 8.14 3.90 0.00 1.79 1.93 0.00 3.03 0.00 0.00 3.00 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.85 0.00 32 E 8.30 3.98 0.00 2.21 2.01 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 2.42 2.47 0.00 33 E 8.23 4.06 0.00 2.17 2.01 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 2.35 2.35 0.00 34 L 8.07 4.01 0.00 1.88 1.89 0.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.09 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.94 3.85 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 37 R 7.87 3.92 0.00 1.97 1.98 0.00 3.20 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 38 A 7.68 4.38 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 39 K 7.63 3.78 0.00 1.88 1.88 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.39 7.81 40 L 8.07 4.90 0.00 1.60 1.63 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.09 4.24 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 1.23 0.00 0.00 42 E 8.74 4.00 0.00 2.17 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 2.38 2.31 0.00 43 A 7.96 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 4.03 0.00 2.07 2.11 0.00 3.21 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 45 V 7.72 3.75 2.30 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 1.09 0.00 0.00 1.00 0.00 0.00 46 Q 8.37 4.07 0.00 2.46 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 47 V 8.06 3.68 2.22 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 1.03 0.00 0.00 1.00 0.00 0.00 48 W 8.57 4.07 0.00 3.46 3.32 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 49 F 8.61 3.84 0.00 3.41 3.12 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 0.00 50 S 8.05 4.07 0.00 3.96 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 51 N 7.99 4.28 0.00 2.63 2.62 0.00 0.00 6.72 7.82 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 52 R 7.12 3.16 0.00 0.67 0.66 0.00 2.31 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 53 R 7.73 4.04 0.00 2.04 2.01 0.00 2.74 0.00 0.00 2.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 54 A 7.72 4.01 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.47 3.83 0.00 1.68 1.93 0.00 3.20 0.00 0.00 3.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 56 W 7.89 4.33 0.00 3.53 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.11 3.92 0.00 1.90 1.97 0.00 3.35 0.00 0.00 3.49 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 58 K 7.80 4.11 0.00 1.90 1.73 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.35 7.81 59 Q 7.29 4.36 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.52 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00