NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4432 8.3049 120.3268 55.4794 33.6878 175.8949 2 K 4.0707 8.2290 120.9568 53.9757 30.5437 173.9753 3 L 4.5165 7.7508 120.2306 53.5516 44.4486 176.5851 4 S 4.6692 7.8202 122.5698 55.4287 62.8182 171.7946 5 R 4.4737 7.6481 128.5647 55.7775 34.1145 175.7237 6 R 4.0583 7.8075 117.7117 59.3961 29.4654 178.1403 7 S 4.1601 7.9849 111.8059 61.0806 62.4917 175.2091 8 F 4.2713 8.0956 122.8910 61.0593 39.2914 176.9978 9 M 3.9983 9.0369 118.2617 58.6611 32.1708 177.9288 10 K 3.7883 8.0301 119.3832 59.5629 31.8836 178.4585 11 A 3.8720 7.3202 119.8767 55.1283 18.6823 178.9486 12 N 4.3499 7.7355 114.0951 55.8104 38.8204 177.2655 13 A 3.9654 8.4985 122.5888 55.5513 18.5022 180.1379 14 V 3.5175 7.7726 110.3950 64.4979 31.2192 178.7106 15 A 4.1028 7.9733 120.1943 54.4129 17.9848 178.7131 16 A 4.1584 7.8028 116.3791 52.8681 19.9752 178.0204 17 A 4.3660 8.0926 118.6848 53.0214 19.7349 179.2218 18 A 4.0760 8.3690 119.7108 55.1007 18.8495 179.4054 19 A 4.1386 7.4222 116.1176 53.5649 18.4661 177.5768 20 A 4.3811 7.7735 117.7134 53.6613 20.8950 177.4014 21 A 4.3951 8.1800 117.2122 51.4353 18.6976 177.8351 22 G 4.1828 7.8852 104.0182 47.1449 0.0000 175.7356 23 L 4.1772 7.0537 121.6849 54.3853 42.8388 176.3597 24 S 4.4742 8.3839 111.7054 58.2906 63.2124 175.6659 25 V 4.2644 7.7780 118.3219 59.0913 30.6141 174.2889 26 P 4.3286 0.0000 0.0000 65.2773 31.8010 179.1510 27 G 4.0310 7.9519 105.5166 44.5622 0.0000 173.3736 28 V 4.1641 7.8299 116.2069 62.1647 31.5391 174.9937 29 A 4.4165 7.3207 118.0661 53.5287 20.8445 175.7151 30 R 3.9181 7.8946 123.3285 56.3299 29.4072 176.1192 31 A 4.6844 8.1785 121.4315 51.3526 20.8016 178.0336 32 V 3.7356 7.9960 110.6424 63.3151 31.8212 176.4002 33 V 4.4718 7.2976 119.2581 59.7999 33.9413 174.8919 34 G 3.9974 8.0722 109.8206 43.5835 0.0000 173.2816 35 Q 3.7936 8.9330 124.7559 56.1872 28.9057 173.0360 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 M 8.30 4.44 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 K 8.23 4.07 0.00 1.81 1.76 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.49 7.81 3 L 7.75 4.52 0.00 1.58 1.58 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.82 4.67 0.00 3.80 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 5 R 7.65 4.47 0.00 1.78 1.85 0.00 3.47 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.37 0.00 6 R 7.81 4.06 0.00 1.94 1.96 0.00 3.24 0.00 0.00 3.28 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 7 S 7.98 4.16 0.00 3.94 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 8 F 8.10 4.27 0.00 3.19 3.12 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 0.00 9 M 9.04 4.00 0.00 2.15 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.60 0.00 10 K 8.03 3.79 0.00 1.89 1.90 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.62 7.81 11 A 7.32 3.87 1.16 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 12 N 7.74 4.35 0.00 2.49 2.76 0.00 0.00 6.48 7.92 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 13 A 8.50 3.97 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 14 V 7.77 3.52 2.06 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 0.84 0.00 0.00 0.90 0.00 0.00 15 A 7.97 4.10 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 16 A 7.80 4.16 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 4.37 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.37 4.08 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.42 4.14 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 20 A 7.77 4.38 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 21 A 8.18 4.40 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 22 G 7.89 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.05 4.18 0.00 1.89 1.63 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.38 4.47 0.00 3.86 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.78 4.26 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 0.89 0.00 0.00 0.92 0.00 0.00 26 P 0.00 4.33 0.00 2.15 2.16 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 27 G 7.95 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 0.00 0.00 0.00 28 V 7.83 4.16 2.06 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 0.78 0.00 0.00 0.91 0.00 0.00 29 A 7.32 4.42 1.21 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 0.00 0.00 0.00 30 R 7.89 3.92 0.00 1.80 1.97 0.00 3.15 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 31 A 8.18 4.68 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 32 V 8.00 3.74 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 33 V 7.30 4.47 2.08 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 0.77 0.00 0.00 0.93 0.00 0.00 34 G 8.07 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 35 Q 8.93 3.79 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.60 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00