NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.4296 8.4444 118.8100 55.7339 31.7048 175.3027 20 I 4.2965 7.5009 119.7793 58.8603 40.4373 171.6455 21 D 4.5398 8.2832 125.7024 53.4297 44.9832 170.9818 22 Y 4.5404 9.8497 119.5852 56.9711 40.0479 170.5435 23 K 3.5796 8.4441 127.1173 57.9316 28.8817 176.0791 24 D 4.6519 7.5997 118.1304 51.5834 42.1572 175.1900 25 I 3.5882 8.4725 125.9104 64.8921 37.7370 176.0706 26 A 3.8704 8.3322 118.0884 55.2915 17.9946 178.6919 27 T 3.8135 7.7817 104.9603 64.5743 68.6855 176.6080 28 L 3.9903 7.3771 122.1922 57.2072 41.5071 179.4208 29 K 3.9609 7.5321 116.5840 58.8765 32.3342 178.5435 30 N 4.6563 7.9216 117.5036 55.8428 38.6885 176.9284 31 Y 4.8706 7.7322 116.0307 57.9010 38.3986 175.7946 32 I 4.6109 7.5296 112.4629 59.2254 40.2862 174.8404 33 T 4.0144 7.9828 119.0923 61.9319 68.0271 173.9072 34 E 4.6629 8.3691 126.6274 55.5582 26.9725 176.9036 35 S 4.6863 7.4327 111.2054 59.0572 68.8756 175.5245 36 G 3.9069 8.0773 108.1261 47.0384 0.0000 173.2625 37 K 4.4722 7.5561 116.7276 53.8210 35.8105 176.6247 38 I 4.1667 7.9964 122.3302 61.0926 38.1670 175.3826 39 V 4.4868 7.7009 113.2395 58.7139 35.0187 173.8977 40 P 4.4808 0.0000 0.0000 62.9261 31.9423 176.5520 41 S 4.3272 8.3847 113.7391 60.1251 63.1621 176.3963 42 R 4.1405 7.8257 114.9464 57.3095 29.7877 176.9470 43 I 4.1466 7.3756 118.7053 63.4080 38.4772 176.7562 44 T 3.7160 7.7599 109.4919 63.7510 68.3331 175.1791 45 G 3.7922 8.1917 108.5638 45.7406 0.0000 173.5122 46 T 4.1028 7.8521 108.8789 61.5893 69.2754 173.9830 47 R 4.3743 8.6484 120.1100 55.2179 32.5164 177.2160 48 A 3.9589 8.5447 123.3079 55.5167 18.2929 179.8630 49 K 3.7287 8.0292 116.8048 60.0548 32.1670 177.8556 50 Y 4.5272 8.0414 116.1597 61.5757 37.7189 178.4397 51 Q 4.0364 8.3051 119.8314 59.3657 29.0396 178.3878 52 R 3.8655 8.5630 119.6983 59.6900 29.7481 178.0784 53 Q 4.0332 8.3115 117.8229 59.2864 28.7951 179.6452 54 L 4.0424 8.2304 119.3188 57.6283 41.6055 179.1011 55 A 3.9813 8.1582 120.8506 55.3507 18.1162 179.2007 56 R 3.7458 7.6169 116.7800 59.9025 30.0244 177.8594 57 A 3.7863 7.6328 118.6536 55.6853 18.2662 179.3720 58 I 3.5605 7.8777 117.1895 64.7983 37.3684 178.3541 59 K 3.7043 7.9317 118.5143 59.5620 31.6732 179.2863 60 R 3.9522 7.6541 117.8338 59.5917 30.0869 178.6750 61 A 4.1337 8.2099 120.0524 55.4440 18.3304 179.9355 62 R 4.5840 8.0752 117.8190 59.1039 29.9195 178.3664 63 Y 4.6385 6.9661 113.4378 58.3709 38.5450 176.0378 64 L 4.6869 7.0143 117.2922 53.4749 43.3640 176.3616 65 S 3.7528 7.8590 112.2246 59.7532 61.0937 172.3387 66 L 4.6946 8.0748 116.0468 54.1560 43.0520 176.7688 67 L 4.8968 7.4184 118.5019 51.8611 45.5520 174.2320 68 P 4.7845 0.0000 0.0000 62.9938 31.9149 175.2313 69 Y 4.7361 8.7440 118.9246 58.0342 40.9531 176.2740 70 T 4.1805 7.9930 108.3329 62.2097 69.6061 173.3467 71 D 4.7354 8.6017 119.2671 54.2350 43.1634 176.1445 72 R 4.6084 8.0521 115.0355 56.8915 31.8478 175.6515 73 H 4.4018 7.8918 119.5661 56.0268 29.8438 172.9842 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 19 E 8.44 4.43 0.00 2.16 2.25 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 2.21 2.29 0.00 20 I 7.50 4.30 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 1.34 1.01 0.93 0.00 0.00 21 D 8.28 4.54 0.00 2.64 2.52 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 22 Y 9.85 4.54 0.00 2.88 3.05 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 23 K 8.44 3.58 0.00 1.62 1.63 0.00 0.92 0.00 0.00 1.07 0.00 0.00 2.81 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.82 0.21 7.81 24 D 7.60 4.65 0.00 2.68 2.75 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 0.00 0.00 0.00 0.00 25 I 8.47 3.59 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.17 0.89 0.00 0.00 26 A 8.33 3.87 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 27 T 7.78 3.81 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 1.11 0.00 0.00 28 L 7.38 3.99 0.00 1.91 1.78 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.53 3.96 0.00 1.87 1.90 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.65 7.81 30 N 7.92 4.66 0.00 2.96 3.13 0.00 0.00 6.84 7.32 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 31 Y 7.73 4.87 0.00 2.94 2.90 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 32 I 7.53 4.61 1.98 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.58 0.93 0.00 0.00 33 T 7.98 4.01 4.21 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 0.00 0.00 0.00 1.23 0.00 0.00 34 E 8.37 4.66 0.00 1.97 1.91 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 2.32 2.39 0.00 35 S 7.43 4.69 0.00 3.76 3.80 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 0.00 0.00 0.00 36 G 8.08 3.91 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 0.00 0.00 0.00 37 K 7.56 4.47 0.00 1.70 1.57 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.30 7.81 38 I 8.00 4.17 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.41 0.91 0.00 0.00 39 V 7.70 4.49 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 0.73 0.00 0.00 0.85 0.00 0.00 40 P 0.00 4.48 0.00 2.14 2.04 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 41 S 8.38 4.33 0.00 3.89 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 42 R 7.83 4.14 0.00 1.90 2.03 0.00 3.00 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 43 I 7.38 4.15 1.79 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 1.43 0.84 0.86 0.00 0.00 44 T 7.76 3.72 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 0.63 0.00 0.00 45 G 8.19 3.79 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 0.00 0.00 0.00 46 T 7.85 4.10 4.38 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 1.19 0.00 0.00 47 R 8.65 4.37 0.00 1.76 1.81 0.00 3.29 0.00 0.00 3.36 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.55 0.00 48 A 8.54 3.96 1.31 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 0.00 0.00 0.00 49 K 8.03 3.73 0.00 1.76 1.67 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 50 Y 8.04 4.53 0.00 3.32 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 51 Q 8.31 4.04 0.00 2.31 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 52 R 8.56 3.87 0.00 1.99 2.05 0.00 3.23 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 1.63 1.73 0.00 53 Q 8.31 4.03 0.00 2.47 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 54 L 8.23 4.04 0.00 1.95 1.80 1.05 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.16 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.62 3.75 0.00 1.82 2.10 0.00 3.08 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 57 A 7.63 3.79 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.88 3.56 2.12 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.80 0.90 0.00 0.00 59 K 7.93 3.70 0.00 1.85 1.75 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.60 7.81 60 R 7.65 3.95 0.00 2.18 2.22 0.00 3.17 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 61 A 8.21 4.13 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 4.58 0.00 1.79 2.00 0.00 3.24 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 63 Y 6.97 4.64 0.00 3.13 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 64 L 7.01 4.69 0.00 1.69 1.65 1.01 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.86 3.75 0.00 4.02 3.91 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 66 L 8.07 4.69 0.00 1.63 1.63 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.42 4.90 0.00 1.66 1.51 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.78 0.00 2.22 2.09 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 69 Y 8.74 4.74 0.00 3.07 3.01 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 0.00 0.00 0.00 70 T 7.99 4.18 4.45 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 0.00 0.00 0.00 1.37 0.00 0.00 71 D 8.60 4.74 0.00 2.87 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 72 R 8.05 4.61 0.00 1.78 1.74 0.00 3.31 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 73 H 7.89 4.40 0.00 3.12 3.15 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00