NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.1735 8.4449 120.2168 55.2987 30.9095 175.0362 2 P 4.1930 0.0000 0.0000 60.0656 31.9588 173.2618 3 E 4.3624 9.1086 119.3539 55.7814 31.4903 176.8176 4 V 4.1350 8.3527 114.3488 61.1828 32.3469 174.1467 5 P 5.3494 0.0000 0.0000 62.3060 32.4657 175.2334 6 F 5.0395 7.8192 115.0576 55.5849 41.6654 173.1521 7 K 4.8675 8.7823 119.3853 56.1257 33.7257 176.2447 8 V 5.0538 8.7464 116.0317 59.6466 36.7620 174.5414 9 V 4.7049 8.6965 121.4055 60.6824 34.5454 174.6396 10 A 4.5388 8.7402 130.6423 52.7854 18.5864 177.9913 11 Q 4.0040 9.3393 122.2522 57.4975 29.6866 176.2392 12 F 5.0353 8.0831 115.4884 54.8007 43.2603 172.7726 13 P 4.7169 0.0000 0.0000 63.2744 32.4271 175.1412 14 Y 4.4020 8.3763 123.2088 55.8260 41.0249 174.3296 15 K 4.7385 8.1264 126.6001 54.5475 34.6180 175.8159 16 S 4.2469 8.9616 119.3008 57.2259 66.0798 173.4061 17 D 4.3641 7.6475 118.2521 54.9524 41.3885 176.4020 18 Y 4.9289 7.0253 117.1824 55.8320 39.7675 176.3031 19 E 4.0237 8.9308 124.2816 59.2394 30.2341 177.6781 20 D 4.6219 8.1158 117.6116 56.1356 41.5177 175.8981 21 D 5.1375 7.7300 118.9956 54.0124 41.6892 175.8475 22 L 4.5413 8.9882 124.9653 54.6648 42.9102 175.6300 23 N 5.2365 8.4779 122.6493 51.7568 42.1227 173.3020 24 F 4.7894 7.9721 113.7255 56.5669 41.6459 173.0245 25 E 4.8154 8.4671 119.3343 54.5284 31.7537 175.7034 26 K 3.8683 8.5482 121.7523 58.7113 32.3980 176.6561 27 D 4.7543 8.8241 124.1883 53.9581 39.8389 174.6464 28 Q 3.8807 7.5203 121.9754 55.9939 29.9580 174.6692 29 E 4.6505 8.4916 127.6261 55.7825 30.7728 175.4470 30 I 4.7372 8.5993 126.6721 59.5543 41.8522 174.2935 31 I 4.4673 8.5820 127.1909 59.8935 38.8435 175.1862 32 V 4.1412 8.3391 129.2556 62.8825 31.6569 176.2005 33 T 4.6114 8.8812 117.8514 61.8286 70.4057 174.2089 34 S 4.6540 7.9366 116.0987 57.1162 66.2789 172.7945 35 V 4.6925 8.3985 125.7546 61.8308 31.6277 175.3916 36 E 4.2287 9.3110 129.2661 58.9650 29.8419 176.3623 37 D 4.5187 7.4249 115.0903 53.1036 41.5341 175.3131 38 A 3.9810 8.8147 120.7096 55.0538 18.8112 178.3078 39 E 4.2595 8.8885 115.2723 56.5581 31.8777 176.3855 40 W 4.9663 7.9900 118.8515 54.9368 32.4296 174.9010 41 Y 5.2711 8.3588 121.3608 56.5404 40.3341 174.2158 42 F 5.1898 8.8695 124.0520 57.0059 42.5317 174.9916 43 G 4.5059 8.2498 110.7561 46.5289 0.0000 171.5326 44 E 5.4088 8.6948 116.7758 55.6416 33.5237 173.6050 45 Y 5.0487 8.2889 117.5409 56.1730 42.1111 173.0625 46 Q 4.8672 8.6592 121.9148 54.7733 30.3160 175.2811 47 D 4.9569 8.8235 127.4924 52.5449 41.1209 177.0965 48 S 4.2785 8.5108 114.0185 61.3814 62.8586 175.3905 49 N 4.4211 8.2245 115.9481 54.0260 38.4078 175.9133 50 G 3.9262 8.1761 106.7055 45.3805 0.0000 172.8999 51 D 4.7627 8.0553 120.1816 52.8926 42.6587 175.9547 52 V 4.3019 8.3076 123.5310 62.5751 32.3541 175.0737 53 I 4.7590 8.5453 121.4431 59.0129 40.8267 174.1117 54 E 4.9296 9.2673 120.3193 54.2142 33.2423 175.2331 55 G 3.8165 6.7739 107.5483 45.5950 0.0000 171.1334 56 I 5.1347 7.4523 112.7997 60.1845 39.8703 174.8997 57 F 5.3400 8.8745 117.3819 55.4777 41.7382 171.3166 58 P 3.9583 0.0000 0.0000 61.7972 31.9620 177.7384 59 K 3.6863 8.3687 124.2513 59.4879 32.1188 179.4411 60 S 4.2376 7.8430 111.8142 60.6915 63.1655 174.9332 61 F 4.4530 8.6110 119.2462 58.5381 39.1384 175.0064 62 V 5.1914 7.9249 112.7068 59.3877 35.5722 174.6742 63 A 4.9019 8.6491 122.8081 49.7505 22.1205 176.0419 64 V 3.9996 8.5711 121.1978 63.2743 32.3332 175.3553 65 Q 3.9083 9.3837 129.6957 57.4965 29.7065 176.0889 66 G 4.1768 8.1012 114.1638 45.5393 0.0000 174.6314 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 E 8.44 4.17 0.00 1.95 1.80 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 2.24 2.39 0.00 2 P 0.00 4.19 0.00 1.50 1.73 0.00 2.22 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.73 0.00 3 E 9.11 4.36 0.00 2.13 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 2.30 2.38 0.00 4 V 8.35 4.13 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 0.82 0.00 0.00 1.04 0.00 0.00 5 P 0.00 5.35 0.00 2.07 2.04 0.00 3.41 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.82 0.00 6 F 7.82 5.04 0.00 3.07 3.08 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 7 K 8.78 4.87 0.00 1.78 1.76 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.49 7.81 8 V 8.75 5.05 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 0.90 0.00 0.00 1.00 0.00 0.00 9 V 8.70 4.70 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 0.92 0.00 0.00 0.89 0.00 0.00 10 A 8.74 4.54 1.28 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 0.00 0.00 0.00 11 Q 9.34 4.00 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 12 F 8.08 5.04 0.00 2.86 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 13 P 0.00 4.72 0.00 2.13 2.14 0.00 4.06 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 14 Y 8.38 4.40 0.00 2.36 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.13 4.74 0.00 1.45 1.50 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.21 1.24 7.81 16 S 8.96 4.25 0.00 3.57 3.15 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 0.00 17 D 7.65 4.36 0.00 2.03 2.49 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 18 Y 7.03 4.93 0.00 3.23 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 19 E 8.93 4.02 0.00 1.96 2.03 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 2.31 2.30 0.00 20 D 8.12 4.62 0.00 2.76 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 D 7.73 5.14 0.00 2.95 2.86 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 22 L 8.99 4.54 0.00 1.88 1.95 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.48 5.24 0.00 2.57 2.57 0.00 0.00 6.90 7.45 0.00 0.00 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 F 7.97 4.79 0.00 2.86 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 25 E 8.47 4.82 0.00 1.93 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 2.39 2.26 0.00 26 K 8.55 3.87 0.00 1.75 1.74 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.52 7.81 27 D 8.82 4.75 0.00 2.82 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 28 Q 7.52 3.88 0.00 1.97 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 29 E 8.49 4.65 0.00 1.94 1.74 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 2.21 2.40 0.00 30 I 8.60 4.74 1.56 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.06 0.81 0.00 0.00 31 I 8.58 4.47 1.85 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 1.09 0.68 0.85 0.00 0.00 32 V 8.34 4.14 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.16 0.00 0.00 33 T 8.88 4.61 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 1.28 0.00 0.00 34 S 7.94 4.65 0.00 3.86 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 35 V 8.40 4.69 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 1.10 0.00 0.00 1.24 0.00 0.00 36 E 9.31 4.23 0.00 2.28 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 0.00 2.50 2.52 0.00 37 D 7.42 4.52 0.00 2.90 2.82 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 38 A 8.81 3.98 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 39 E 8.89 4.26 0.00 2.03 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 2.13 2.24 0.00 40 W 7.99 4.97 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.36 5.27 0.00 1.57 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 0.00 0.00 0.00 0.00 42 F 8.87 5.19 0.00 3.23 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 43 G 8.25 4.51 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 0.00 0.00 0.00 44 E 8.69 5.41 0.00 2.02 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 0.00 2.20 2.26 0.00 45 Y 8.29 5.05 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.66 4.87 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.04 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 47 D 8.82 4.96 0.00 3.02 2.76 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 48 S 8.51 4.28 0.00 3.91 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 49 N 8.22 4.42 0.00 2.89 2.87 0.00 0.00 7.02 7.65 0.00 0.00 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 G 8.18 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 0.00 0.00 0.00 51 D 8.06 4.76 0.00 2.90 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.31 4.30 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 0.74 0.00 0.00 0.91 0.00 0.00 53 I 8.55 4.76 1.69 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.12 0.78 0.00 0.00 54 E 9.27 4.93 0.00 1.83 1.81 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 2.21 2.44 0.00 55 G 6.77 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 56 I 7.45 5.13 2.01 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.32 1.15 0.00 0.00 57 F 8.87 5.34 0.00 3.09 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 3.96 0.00 1.95 1.23 0.00 2.62 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.11 0.00 59 K 8.37 3.69 0.00 1.48 1.52 0.00 1.45 0.00 0.00 1.20 0.00 0.00 2.52 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 0.71 7.81 60 S 7.84 4.24 0.00 3.91 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 61 F 8.61 4.45 0.00 3.50 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 62 V 7.92 5.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.41 0.00 0.00 63 A 8.65 4.90 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 64 V 8.57 4.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.99 0.00 0.00 65 Q 9.38 3.91 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.99 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 66 G 8.10 4.18 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 0.00