NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 46 M 4.3469 8.3001 120.3123 55.3910 33.4976 175.2152 47 A 4.4592 8.0640 125.3361 49.6623 19.4384 175.6848 48 T 3.8056 8.5634 113.2419 63.2652 69.4510 172.5303 49 T 4.3152 7.9935 123.1812 62.2813 70.0014 175.1860 50 T 4.0869 8.2692 120.4068 63.5284 68.4427 174.3740 51 L 4.7845 8.2504 126.1441 52.7628 45.0833 177.5583 52 G 3.8731 8.2304 110.8762 44.5117 0.0000 173.6526 53 V 3.8482 7.3025 119.1438 62.3651 32.9667 175.1239 54 K 4.4576 8.4390 126.1921 55.1193 33.0670 176.0676 55 L 4.8044 8.1160 122.7731 52.3075 45.7077 176.3033 56 D 4.6828 8.2488 119.9055 53.2872 43.1412 176.9920 57 D 4.2910 8.4499 122.3043 57.0725 41.5509 176.8279 58 P 4.3226 0.0000 0.0000 66.1045 31.3054 178.3950 59 T 3.9543 7.8617 115.1676 66.1485 68.3471 176.7402 60 R 3.8754 7.7564 119.8985 59.4532 30.0959 178.8600 61 E 3.9779 7.8327 117.4152 59.4256 29.4530 179.4291 62 R 3.8785 7.9228 118.4414 59.3380 30.2406 178.3838 63 L 3.9855 7.9651 120.2271 57.9668 41.7126 178.8820 64 K 3.9862 8.1548 119.5152 59.3813 32.0931 178.7079 65 A 4.0032 8.4519 121.3307 55.0850 18.2862 179.4581 66 A 3.9777 8.2167 119.1212 55.1607 18.3691 179.6385 67 A 4.0080 7.8718 118.9848 55.5272 18.5302 179.9253 68 Q 3.9917 7.8660 116.0748 59.1944 28.5457 179.1049 69 S 4.1722 7.6745 114.9736 61.2015 62.9918 175.6674 70 I 4.0359 7.6381 118.1099 59.8489 38.8531 174.3885 71 D 4.3802 7.8249 116.1031 55.9778 39.6054 172.9888 72 R 4.6763 8.3212 116.4346 53.6123 34.9023 176.3563 73 T 4.0771 8.2616 114.4218 61.3467 69.2806 173.3539 74 P 4.2890 0.0000 0.0000 66.3705 30.0389 178.2957 75 H 4.2750 8.3235 116.1960 59.1024 29.8283 176.9743 76 W 4.1487 8.2779 129.7611 60.2626 30.7026 177.6152 77 L 4.1214 8.6002 120.7917 58.0846 41.5753 178.9992 78 I 3.7077 7.7893 119.9135 64.4193 37.1110 178.5531 79 K 4.0592 7.4418 119.1020 59.4884 31.7680 179.5733 80 Q 4.0888 8.1489 118.2118 58.6563 28.7160 178.4763 81 A 4.0484 8.6441 122.2388 55.3862 17.9694 179.6151 82 I 3.7358 7.4405 115.8070 64.0980 38.0940 177.8857 83 F 4.1354 8.3103 121.6281 61.3316 39.2908 176.7269 84 N 4.4301 9.1061 117.0411 56.3304 38.4267 176.2395 85 Y 4.1238 7.8300 120.9338 60.8656 38.8596 178.2494 86 L 3.8569 7.6010 118.5812 57.3180 41.3859 179.1418 87 E 3.7599 7.4476 118.4943 59.0322 29.6339 178.5932 88 K 4.0569 8.2798 118.3245 58.9193 32.1622 178.5321 89 L 4.1150 7.2276 117.1223 55.5626 41.1485 176.4777 90 E 4.0579 8.0361 123.0756 56.7045 30.1853 174.0395 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 46 M 8.30 4.35 0.00 1.82 1.87 0.00 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 47 A 8.06 4.46 1.22 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 0.00 0.00 48 T 8.56 3.81 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 1.07 0.00 0.00 49 T 7.99 4.32 4.22 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 1.20 0.00 0.00 50 T 8.27 4.09 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 1.21 0.00 0.00 51 L 8.25 4.78 0.00 1.59 1.54 0.92 0.96 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 52 G 8.23 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 0.00 0.00 0.00 0.00 53 V 7.30 3.85 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 0.81 0.00 0.00 0.92 0.00 0.00 54 K 8.44 4.46 0.00 1.74 1.72 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.50 7.81 55 L 8.12 4.80 0.00 1.56 1.50 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.25 4.68 0.00 2.69 2.51 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 D 8.45 4.29 0.00 2.82 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 58 P 0.00 4.32 0.00 2.30 2.29 0.00 3.87 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 2.07 2.05 0.00 59 T 7.86 3.95 4.37 0.00 0.00 0.00 0.00 0.00 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 60 R 7.76 3.88 0.00 2.08 1.98 0.00 3.29 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 61 E 7.83 3.98 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 2.33 2.32 0.00 62 R 7.92 3.88 0.00 2.08 2.00 0.00 3.26 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 63 L 7.97 3.99 0.00 1.98 1.81 0.94 0.37 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 64 K 8.15 3.99 0.00 1.90 1.95 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 65 A 8.45 4.00 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 66 A 8.22 3.98 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.87 4.01 1.52 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 0.00 0.00 0.00 68 Q 7.87 3.99 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 69 S 7.67 4.17 0.00 4.02 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 70 I 7.64 4.04 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.81 1.06 0.00 0.00 71 D 7.82 4.38 0.00 2.84 2.66 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 0.00 0.00 0.00 0.00 72 R 8.32 4.68 0.00 1.80 1.82 0.00 3.24 0.00 0.00 3.05 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 73 T 8.26 4.08 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 1.31 0.00 0.00 74 P 0.00 4.29 0.00 2.24 2.15 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 75 H 8.32 4.27 0.00 3.25 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 W 8.28 4.15 0.00 3.50 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 77 L 8.60 4.12 0.00 1.95 1.86 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.79 3.71 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.95 0.91 0.00 0.00 79 K 7.44 4.06 0.00 1.71 1.60 0.00 1.28 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.25 7.81 80 Q 8.15 4.09 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.71 2.77 0.00 81 A 8.64 4.05 1.40 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 0.00 0.00 0.00 82 I 7.44 3.74 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.27 1.04 0.00 0.00 83 F 8.31 4.14 0.00 3.30 3.06 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 0.00 0.00 0.00 84 N 9.11 4.43 0.00 2.96 2.92 0.00 0.00 7.05 8.24 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 85 Y 7.83 4.12 0.00 3.23 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.60 3.86 0.00 1.63 1.51 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 87 E 7.45 3.76 0.00 1.87 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 2.29 2.28 0.00 88 K 8.28 4.06 0.00 1.76 1.79 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.70 7.81 89 L 7.23 4.11 0.00 1.66 1.58 0.71 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.04 4.06 0.00 2.05 1.89 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 2.16 2.37 0.00