NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5976 8.1744 111.0829 61.9365 70.5567 172.1051 2 Q 4.5390 8.7386 121.6507 52.8584 33.2031 172.6942 3 S 4.8940 8.7145 119.6234 56.8230 66.3252 171.9219 4 H 4.2310 8.9471 119.8690 56.9146 30.1614 173.3037 5 Y 3.7297 7.8162 117.2363 58.6042 36.3402 170.8553 6 G 4.0696 7.6081 106.1810 44.4869 0.0000 173.5926 7 Q 4.3356 8.7144 125.7812 56.5928 28.1730 174.3810 8 C 4.3990 8.9799 122.7931 56.5794 43.4755 173.4188 9 G 3.8037 7.1487 106.5386 44.3186 0.0000 170.3530 10 G 3.6793 9.0408 104.1548 43.2783 0.0000 173.7373 11 I 3.8070 7.1495 126.6529 63.0055 37.6336 176.8587 12 G 4.1068 8.8740 110.6830 45.9241 0.0000 173.3698 13 Y 4.3723 8.1830 121.6136 57.3950 39.8622 175.6893 14 S 4.4660 7.3141 119.3929 56.3911 62.7479 171.5801 15 G 3.8915 6.5007 109.2798 43.7210 0.0000 168.4650 16 P 4.5398 0.0000 0.0000 63.0801 31.6190 176.6318 17 T 4.7071 8.0529 105.3476 59.7804 70.3303 173.8685 18 V 3.8999 7.6538 123.8133 62.6345 32.2447 175.8918 19 C 4.9826 8.7559 125.7262 56.4421 36.7774 173.7344 20 A 4.2272 8.9134 124.5902 51.9781 19.1174 177.4649 21 S 4.1474 8.6862 116.9003 60.4591 63.5116 174.3673 22 G 4.0395 9.1651 111.0852 45.1018 0.0000 173.4083 23 T 4.5820 7.2989 107.7687 59.7094 71.7543 172.5346 24 T 4.6783 7.8668 110.9775 59.9526 72.9852 172.7460 25 C 4.8263 8.6030 121.8850 55.4796 39.0213 172.4410 26 Q 4.5343 8.6264 126.0727 53.8509 30.6195 175.5920 27 V 4.0581 8.2855 124.4410 61.9078 31.2688 175.5876 28 L 4.1240 8.4745 129.6604 57.7036 42.4553 176.2027 29 N 5.0754 8.2594 113.5461 51.5276 42.7380 173.8315 30 P 4.5724 0.0000 0.0000 63.2082 30.4760 178.2680 31 Y 4.8228 8.2057 112.6283 58.5161 40.8550 174.0172 32 Y 4.5226 7.6496 117.5897 56.9662 41.8959 172.9919 33 S 4.6875 7.3491 122.4240 57.1922 66.8716 172.4937 34 Q 4.5488 8.0926 126.4070 54.5411 31.3559 173.8227 35 C 5.3734 8.5110 123.1157 55.7693 41.5188 173.8610 36 L 4.2319 9.1921 123.8848 54.8203 41.9566 176.5371 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 4.60 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 2 Q 8.74 4.54 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 3 S 8.71 4.89 0.00 3.99 4.03 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 4 H 8.95 4.23 0.00 3.09 3.35 0.00 5.89 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 5 Y 7.82 3.73 0.00 3.09 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 6 G 7.61 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.71 4.34 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.18 0.00 0.00 0.00 0.00 0.00 1.16 1.88 0.00 8 C 8.98 4.40 0.00 3.05 3.22 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 9 G 7.15 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 0.00 0.00 0.00 10 G 9.04 3.68 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 0.00 0.00 0.00 11 I 7.15 3.81 1.55 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.31 0.94 0.00 0.00 12 G 8.87 4.11 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 0.00 13 Y 8.18 4.37 0.00 2.91 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 14 S 7.31 4.47 0.00 3.82 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.50 3.89 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 0.00 0.00 0.00 16 P 0.00 4.54 0.00 2.15 2.06 0.00 3.96 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.99 0.00 17 T 8.05 4.71 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 1.35 0.00 0.00 18 V 7.65 3.90 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 1.04 0.00 0.00 0.94 0.00 0.00 19 C 8.76 4.98 0.00 2.86 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.91 4.23 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 21 S 8.69 4.15 0.00 3.85 3.83 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 22 G 9.17 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.30 4.58 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 0.94 0.00 0.00 24 T 7.87 4.68 4.20 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 1.18 0.00 0.00 25 C 8.60 4.83 0.00 2.94 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 26 Q 8.63 4.53 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 27 V 8.29 4.06 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 1.05 0.00 0.00 0.88 0.00 0.00 28 L 8.47 4.12 0.00 1.81 2.01 1.04 1.17 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 29 N 8.26 5.08 0.00 2.91 2.78 0.00 0.00 7.32 7.74 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 30 P 0.00 4.57 0.00 1.83 1.90 0.00 3.79 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 31 Y 8.21 4.82 0.00 2.95 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.65 4.52 0.00 2.98 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 33 S 7.35 4.69 0.00 3.62 3.52 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 34 Q 8.09 4.55 0.00 1.97 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 7.20 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 35 C 8.51 5.37 0.00 2.86 2.93 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 36 L 9.19 4.23 0.00 1.33 1.39 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00