NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3207 8.1744 110.9436 61.3008 70.6024 173.4711 6 N 4.7064 7.9505 119.8950 53.2556 39.0766 173.0001 7 S 4.5172 8.1242 112.3634 57.8646 64.9611 172.9713 8 D 4.8588 8.7214 120.9240 54.3318 42.5042 174.5067 9 F 5.3372 7.7651 116.1901 55.4787 41.7520 173.8263 10 V 4.5417 9.0191 112.2904 59.5319 35.1294 174.9346 11 V 4.8820 8.6662 124.0275 61.3422 33.7028 174.3955 12 I 4.9402 8.7568 128.4600 59.3435 40.5293 174.1659 13 K 4.9775 9.2866 128.7496 54.2746 34.3143 175.0752 14 A 4.3974 8.7530 130.5700 52.4013 18.9344 177.4660 15 L 4.6694 8.9014 122.4766 54.7947 42.7165 176.1850 16 E 4.6921 7.7921 115.3312 54.5853 32.5359 174.4252 17 D 4.5490 8.4274 119.4076 55.2883 41.4434 176.1839 18 G 3.8570 8.6369 106.9447 46.5799 0.0000 174.1740 19 V 3.9778 7.7065 119.5766 62.6283 32.9625 174.3649 20 N 5.2989 9.2836 124.4460 51.4032 41.7856 173.5022 21 V 4.4993 8.5416 123.9211 61.3794 33.6801 174.1125 22 I 4.5410 8.7103 130.1201 59.4908 39.3672 175.0995 23 G 4.1579 8.8082 114.7525 44.9910 0.0000 172.3479 24 L 5.4267 8.9335 125.5283 52.6996 44.1382 176.1858 25 T 4.2813 9.0983 114.6688 62.2388 68.9176 174.0965 26 R 4.1608 8.0563 126.6602 57.0617 29.5621 175.1105 27 G 3.7838 8.7746 108.8382 44.2814 0.0000 174.0460 28 A 4.1741 8.6695 121.4582 54.1687 18.7550 177.5023 29 D 4.8946 7.3165 114.8373 53.1646 42.7586 176.8663 30 T 4.5163 8.2605 123.0595 61.5017 68.1563 172.8353 31 R 4.6903 8.5859 122.6803 53.9238 33.4628 175.4979 32 F 5.2998 8.6706 117.8546 57.7999 39.0262 175.6390 33 H 4.9887 9.1096 118.5801 56.6011 30.7310 173.9679 34 H 4.8937 7.5570 116.7780 54.7534 33.5466 172.1544 35 S 4.7351 7.8454 117.4662 56.4908 65.1834 172.3372 36 E 4.5201 9.1562 129.2861 54.5095 31.2555 174.5418 37 K 4.9584 8.6099 126.9531 55.4722 33.4916 176.0282 38 L 4.9401 8.7739 125.2076 53.1154 44.6568 175.9573 39 D 4.9865 9.3141 123.3458 52.3147 43.4380 175.9288 40 K 3.9656 9.1467 121.8534 58.7626 32.2219 177.0804 41 G 4.0248 9.0382 115.8904 45.1293 0.0000 173.4103 42 E 4.2066 7.9414 119.6721 56.3592 30.7728 176.0184 43 V 4.8984 8.3110 122.3737 61.0224 34.1147 174.1560 44 L 4.7413 8.9296 129.9539 53.2891 44.5311 174.7282 45 I 4.9772 8.3815 126.3104 59.5204 39.4344 174.8506 46 A 4.6774 8.8994 128.1049 50.3910 22.5495 175.0732 47 Q 4.9350 8.5820 120.2737 54.6239 30.7161 175.7317 48 F 4.4991 8.5081 120.9629 57.9760 39.5366 175.1288 49 T 4.7224 8.8415 111.3318 60.0598 71.8969 173.9295 50 E 3.9374 8.9395 120.9131 59.3639 29.6779 177.3314 51 H 4.5895 8.1751 113.7118 56.1424 29.7945 174.2499 52 T 5.1588 7.7788 115.6338 61.9173 71.3581 174.0693 53 S 5.0474 8.7427 120.6482 57.8244 64.7228 173.3874 54 A 4.9893 7.9299 120.9020 51.3716 22.4950 175.4181 55 I 4.8820 8.6932 122.1859 59.3663 39.8155 174.8358 56 K 4.5765 9.0641 128.9222 54.6175 34.5173 174.9100 57 V 4.8445 8.3610 126.2393 61.2224 33.8456 174.4819 58 R 4.5347 9.2461 127.3495 55.6688 32.9448 176.8261 59 G 3.8794 8.9822 109.2048 44.2359 0.0000 172.0897 60 K 4.7792 8.8420 119.4195 55.0766 32.8431 175.6274 61 A 5.1334 8.7955 128.4814 50.7202 23.6283 173.8612 62 Y 4.8819 9.0672 121.6268 56.3901 40.5317 174.4015 63 I 4.7536 8.6287 128.4872 59.5772 39.9257 174.6606 64 Q 4.7101 9.2959 127.0357 54.3518 31.1827 174.9250 65 T 4.8360 8.3873 114.2165 59.3378 72.1303 174.6035 66 R 3.7451 8.5425 120.3578 59.5798 29.8796 176.6649 67 H 4.7220 8.6833 112.9906 55.1407 29.4028 174.1408 68 G 3.7574 6.7262 106.4660 44.0702 0.0000 173.2579 69 V 4.7832 7.7341 112.3297 59.9632 34.9322 175.1107 70 I 4.3417 7.8545 120.2556 60.3592 41.8803 172.6658 71 E 5.3267 8.7810 126.6606 54.5790 31.9361 175.8887 72 S 4.6586 9.2668 119.0049 57.8172 65.1667 172.8603 73 E 4.8420 8.6316 120.1232 54.7783 32.7881 176.1964 74 G 3.9996 8.5266 110.3820 45.0591 0.0000 173.9030 75 K 4.2949 8.4031 118.3278 56.5769 32.3097 177.0017 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 4.32 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 7.95 4.71 0.00 2.80 2.85 0.00 0.00 7.10 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 8.12 4.52 0.00 4.01 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 8.72 4.86 0.00 2.78 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 9 F 7.77 5.34 0.00 3.07 2.97 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 0.00 0.00 0.00 10 V 9.02 4.54 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 0.71 0.00 0.00 0.81 0.00 0.00 11 V 8.67 4.88 2.13 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 1.03 0.00 0.00 1.16 0.00 0.00 12 I 8.76 4.94 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.66 0.91 0.00 0.00 13 K 9.29 4.98 0.00 1.91 1.83 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.41 7.81 14 A 8.75 4.40 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 15 L 8.90 4.67 0.00 1.68 1.72 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.79 4.69 0.00 2.02 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 2.18 2.33 0.00 17 D 8.43 4.55 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 8.64 3.86 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 0.00 0.00 0.00 19 V 7.71 3.98 2.07 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 1.04 0.00 0.00 0.98 0.00 0.00 20 N 9.28 5.30 0.00 2.59 2.56 0.00 0.00 6.40 7.42 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 21 V 8.54 4.50 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 0.88 0.00 0.00 0.89 0.00 0.00 22 I 8.71 4.54 1.40 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.22 -0.59 0.00 0.00 23 G 8.81 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.93 5.43 0.00 1.84 1.69 1.02 0.61 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 9.10 4.28 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 1.35 0.00 0.00 26 R 8.06 4.16 0.00 1.89 1.96 0.00 3.27 0.00 0.00 3.09 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.46 0.00 27 G 8.77 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 28 A 8.67 4.17 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 7.32 4.89 0.00 2.74 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 30 T 8.26 4.52 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 1.27 0.00 0.00 31 R 8.59 4.69 0.00 1.86 2.05 0.00 2.78 0.00 0.00 3.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 32 F 8.67 5.30 0.00 2.90 2.88 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 33 H 9.11 4.99 0.00 3.13 3.50 0.00 5.76 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 7.56 4.89 0.00 3.29 3.05 0.00 5.81 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.85 4.74 0.00 3.64 3.53 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 0.00 0.00 0.00 0.00 36 E 9.16 4.52 0.00 2.13 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 2.22 2.30 0.00 37 K 8.61 4.96 0.00 1.66 1.71 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.39 7.81 38 L 8.77 4.94 0.00 1.56 1.53 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.31 4.99 0.00 2.56 2.70 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 40 K 9.15 3.97 0.00 1.78 1.76 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.55 7.81 41 G 9.04 4.02 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 0.00 0.00 0.00 42 E 7.94 4.21 0.00 2.07 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 2.33 0.00 43 V 8.31 4.90 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 0.87 0.00 0.00 0.96 0.00 0.00 44 L 8.93 4.74 0.00 1.75 1.46 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.38 4.98 1.73 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 0.74 0.60 0.00 0.00 46 A 8.90 4.68 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 8.58 4.94 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 48 F 8.51 4.50 0.00 3.06 3.03 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 49 T 8.84 4.72 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 1.28 0.00 0.00 50 E 8.94 3.94 0.00 1.93 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 2.04 2.26 0.00 51 H 8.18 4.59 0.00 3.23 3.16 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 7.78 5.16 4.34 0.00 0.00 0.00 0.00 0.00 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 53 S 8.74 5.05 0.00 3.83 4.10 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 0.00 0.00 0.00 0.00 54 A 7.93 4.99 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 I 8.69 4.88 1.81 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.58 0.82 0.00 0.00 56 K 9.06 4.58 0.00 1.81 1.55 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.37 7.81 57 V 8.36 4.84 2.07 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 0.86 0.00 0.00 0.90 0.00 0.00 58 R 9.25 4.53 0.00 1.73 1.78 0.00 3.16 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 59 G 8.98 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 60 K 8.84 4.78 0.00 1.99 1.73 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.39 7.81 61 A 8.80 5.13 1.25 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 0.00 0.00 0.00 62 Y 9.07 4.88 0.00 3.04 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 63 I 8.63 4.75 1.88 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 0.47 0.83 0.00 0.00 64 Q 9.30 4.71 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 65 T 8.39 4.84 4.12 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 1.15 0.00 0.00 66 R 8.54 3.75 0.00 1.60 1.74 0.00 3.16 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 67 H 8.68 4.72 0.00 3.12 3.25 0.00 5.69 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 6.73 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 0.00 0.00 0.00 69 V 7.73 4.78 1.86 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 0.71 0.00 0.00 1.00 0.00 0.00 70 I 7.85 4.34 1.83 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 1.22 1.09 0.85 0.00 0.00 71 E 8.78 5.33 0.00 1.91 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 2.45 2.42 0.00 72 S 9.27 4.66 0.00 3.85 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 8.63 4.84 0.00 1.83 1.86 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 2.21 2.29 0.00 74 G 8.53 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.40 4.29 0.00 1.74 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.49 7.81