NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3976 8.1749 117.3245 62.5366 70.0285 173.5419 2 P 4.2564 0.0000 0.0000 62.2249 32.6192 174.1706 3 D 4.5898 8.8119 122.4521 55.0503 41.4789 175.8016 4 C 4.9209 9.1193 122.1828 57.8125 44.2845 174.3803 5 V 4.6621 7.2472 115.8603 60.8648 34.3688 173.1268 6 T 5.4784 7.7784 118.4025 60.9854 72.3753 173.9859 7 G 3.8248 7.9141 112.3857 46.0476 0.0000 171.7360 8 K 4.6114 8.2221 118.2722 55.0505 33.3176 176.8918 9 V 3.7395 8.0791 121.0835 62.4920 31.5582 175.6752 10 E 4.0861 8.9131 130.0246 59.1285 29.8779 175.9482 11 Y 5.1238 6.8260 113.8457 56.5170 40.8311 173.1487 12 T 5.3269 8.7484 110.0984 59.8951 72.2676 173.2377 13 K 4.4682 8.6264 121.6492 55.4095 36.2158 174.4567 14 Y 4.3853 8.5150 125.3270 57.1267 39.3809 174.7093 15 N 4.7678 8.1308 123.8459 51.6056 40.4083 175.7259 16 D 4.3885 8.4550 118.8941 57.0954 41.3964 176.1524 17 D 4.6637 7.9117 117.1647 52.9912 39.4365 176.4406 18 D 3.5926 7.4395 116.3064 55.4097 39.6887 173.9460 19 T 4.4472 7.7337 110.1925 61.1224 71.0014 173.2160 20 F 5.2744 9.2059 124.5470 56.8465 42.2458 173.8666 21 T 5.1893 9.0430 122.9931 62.0936 70.6218 173.7212 22 V 4.6177 8.7526 124.4660 61.0360 35.0537 174.3593 23 K 4.5830 8.5726 128.8853 53.7148 33.1431 174.0335 24 V 4.3040 8.0692 125.9591 61.7551 33.5808 176.1263 25 G 3.8522 8.6116 116.6616 45.6883 0.0000 172.9679 26 D 4.5151 8.4931 118.8034 54.6705 40.4279 177.0253 27 K 4.3071 7.7016 120.3837 56.3058 33.7248 175.6177 28 E 4.8943 8.7557 123.5730 54.2029 30.5836 174.6122 29 L 5.4642 8.3381 125.4464 52.8896 45.4460 174.3829 30 F 5.5571 8.7002 113.8183 56.5241 41.8304 173.1628 31 T 4.4556 9.2331 113.2971 60.3314 70.5802 173.7312 32 N 4.9878 8.7450 123.3869 52.6752 37.8727 174.9181 33 R 4.2766 7.7713 120.0530 55.7400 30.4111 177.6461 34 W 4.2955 9.0342 123.6831 59.4168 29.4601 178.3533 35 N 4.4368 8.2431 114.9501 55.8261 38.2606 176.3720 36 L 4.3526 7.6557 116.0853 55.5791 41.4160 178.7872 37 Q 2.9416 7.5418 119.6029 58.7946 28.6531 178.9150 38 S 4.1283 7.8045 115.3609 61.3712 63.1326 176.1588 39 L 3.7874 7.9280 121.2852 58.2701 41.1411 179.6686 40 L 4.3313 8.0854 117.3363 57.4229 41.9192 178.7713 41 L 4.3404 7.6514 119.0153 57.7654 41.7014 179.0120 42 S 4.1676 8.7312 115.5985 61.1573 62.5371 175.5206 43 A 4.3922 7.7874 120.5583 52.9939 17.0573 177.8896 44 Q 4.4996 7.7138 118.1454 56.9984 30.7146 177.2267 45 I 4.0177 8.0437 119.7515 62.8177 37.2789 176.6383 46 T 4.4539 7.2395 109.7355 60.9320 68.7869 175.7606 47 G 4.0511 8.5018 107.8045 46.6454 0.0000 174.4274 48 M 4.2995 7.4392 117.5984 55.9736 32.8542 175.8871 49 T 4.6745 8.1807 116.6326 62.4920 70.7790 174.4730 50 V 4.7543 9.2190 119.0431 59.8196 36.1724 174.8468 51 T 4.7114 8.3235 118.2669 62.0571 72.0998 173.0854 52 I 4.4431 8.6484 128.6686 59.5979 38.9967 174.8738 53 K 5.1254 8.1573 127.2075 54.4258 33.4183 175.8443 54 T 4.2903 8.1278 117.2713 61.9787 69.7138 172.5532 55 N 4.5300 8.8843 122.1241 55.4135 39.7705 176.8565 56 A 4.3727 7.4359 121.3535 52.0801 15.9959 177.4920 57 C 4.4823 7.5580 121.9781 53.5833 42.0410 171.5752 58 H 4.5183 7.3283 119.3025 54.0926 30.6297 173.7428 59 N 4.5600 8.7710 117.4706 54.9545 38.5246 176.1009 60 G 4.0813 9.1402 111.0944 45.3450 0.0000 173.7638 61 G 3.8438 8.0162 107.7242 45.6542 0.0000 173.6776 62 G 3.7692 8.3646 109.1531 44.3264 0.0000 172.7081 63 F 5.1163 8.0165 114.7994 55.4649 40.7875 174.6282 64 S 4.4954 8.9392 113.5759 57.7626 65.0817 173.6799 65 E 4.8283 8.2455 120.4873 54.4490 32.3074 175.1067 66 V 4.8288 8.3721 122.7943 61.2042 35.5595 174.1599 67 I 4.4276 8.2939 125.6208 59.5330 40.1358 174.3683 68 F 5.0357 8.8472 126.1687 56.0131 40.3692 176.0261 69 R 4.2854 8.5772 123.4149 56.6156 30.4493 174.4839 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 T 8.17 4.40 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 2 P 0.00 4.26 0.00 2.13 1.96 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 3 D 8.81 4.59 0.00 2.51 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.12 4.92 0.00 3.02 3.13 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 5 V 7.25 4.66 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 0.66 0.00 0.00 0.91 0.00 0.00 6 T 7.78 5.48 4.19 0.00 0.00 0.00 0.00 0.00 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 7 G 7.91 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 8 K 8.22 4.61 0.00 1.75 1.74 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.41 7.81 9 V 8.08 3.74 2.12 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 0.81 0.00 0.00 0.97 0.00 0.00 10 E 8.91 4.09 0.00 1.96 1.72 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 2.35 2.23 0.00 11 Y 6.83 5.12 0.00 2.95 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 12 T 8.75 5.33 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 1.44 0.00 0.00 13 K 8.63 4.47 0.00 1.67 1.80 0.00 1.25 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.36 7.81 14 Y 8.52 4.39 0.00 2.93 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.13 4.77 0.00 2.82 2.57 0.00 0.00 6.30 7.85 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 16 D 8.45 4.39 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 4.66 0.00 2.77 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.44 3.59 0.00 2.98 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.73 4.45 4.52 0.00 0.00 0.00 0.00 0.00 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 20 F 9.21 5.27 0.00 2.91 2.78 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 21 T 9.04 5.19 4.35 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 1.38 0.00 0.00 22 V 8.75 4.62 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.16 0.00 0.00 23 K 8.57 4.58 0.00 1.18 0.74 0.00 1.64 0.00 0.00 1.53 0.00 0.00 3.13 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.76 0.87 7.81 24 V 8.07 4.30 1.92 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 0.78 0.00 0.00 0.81 0.00 0.00 25 G 8.61 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.49 4.52 0.00 2.77 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 27 K 7.70 4.31 0.00 1.75 1.71 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.32 7.81 28 E 8.76 4.89 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 29 L 8.34 5.46 0.00 1.63 1.82 0.73 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.70 5.56 0.00 3.32 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.23 4.46 2.77 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 1.17 0.00 0.00 32 N 8.74 4.99 0.00 3.01 3.11 0.00 0.00 6.15 7.66 0.00 0.00 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 R 7.77 4.28 0.00 1.88 1.94 0.00 3.29 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 34 W 9.03 4.30 0.00 3.40 3.24 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.24 4.44 0.00 2.74 2.92 0.00 0.00 6.95 7.85 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 36 L 7.66 4.35 0.00 1.71 1.76 0.95 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 7.54 2.94 0.00 2.02 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.84 0.00 0.00 0.00 0.00 0.00 1.16 1.94 0.00 38 S 7.80 4.13 0.00 3.82 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 39 L 7.93 3.79 0.00 1.90 1.61 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.09 4.33 0.00 1.75 1.97 1.23 1.37 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 41 L 7.65 4.34 0.00 2.04 1.73 1.08 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.73 4.17 0.00 4.09 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 43 A 7.79 4.39 1.59 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 0.00 0.00 44 Q 7.71 4.50 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 45 I 8.04 4.02 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.86 0.93 0.00 0.00 46 T 7.24 4.45 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 1.26 0.00 0.00 47 G 8.50 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 48 M 7.44 4.30 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 49 T 8.18 4.67 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 1.19 0.00 0.00 50 V 9.22 4.75 1.95 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 0.73 0.00 0.00 0.78 0.00 0.00 51 T 8.32 4.71 4.15 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 1.14 0.00 0.00 52 I 8.65 4.44 1.66 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.31 0.19 0.00 0.00 53 K 8.16 5.13 0.00 1.63 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.15 7.81 54 T 8.13 4.29 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 1.17 0.00 0.00 55 N 8.88 4.53 0.00 2.75 2.85 0.00 0.00 6.91 7.35 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 56 A 7.44 4.37 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.56 4.48 0.00 3.08 3.02 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 58 H 7.33 4.52 0.00 3.37 3.39 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.77 4.56 0.00 2.77 2.87 0.00 0.00 6.94 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 60 G 9.14 4.08 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 0.00 0.00 0.00 61 G 8.02 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.36 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 63 F 8.02 5.12 0.00 2.91 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 64 S 8.94 4.50 0.00 3.80 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.25 4.83 0.00 2.07 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 0.00 2.29 2.27 0.00 66 V 8.37 4.83 1.65 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 0.36 0.00 0.00 1.11 0.00 0.00 67 I 8.29 4.43 1.78 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 1.17 0.57 0.90 0.00 0.00 68 F 8.85 5.04 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.58 4.29 0.00 1.79 1.69 0.00 3.12 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00