NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2905 8.1749 110.9401 61.5014 70.1020 172.8129 3 S 4.6706 8.0469 118.1663 56.5436 66.1717 171.9873 4 Y 4.7274 9.0892 120.4692 56.7616 42.4882 174.7092 5 T 4.7768 8.1977 117.5545 62.3788 72.7707 173.6413 6 L 4.3226 8.2492 124.1107 54.4328 44.6425 173.8944 7 N 5.0299 8.5119 124.5332 52.0803 41.1721 172.8013 8 E 4.5851 8.2589 122.3540 55.3852 32.5358 174.3391 9 V 4.1988 8.2573 122.7142 61.0929 32.1357 175.6219 10 V 4.5051 8.1773 126.7864 59.3113 33.4696 174.4490 11 P 4.5576 0.0000 0.0000 60.9721 29.9477 176.1530 12 L 4.0612 8.4355 127.9098 58.7905 41.5400 178.7227 13 K 3.8917 7.9525 116.8857 59.8478 32.2967 178.3768 14 E 3.8620 7.7395 119.1353 57.9689 29.3588 177.3387 15 F 4.8600 7.4902 116.1140 58.4209 40.5311 176.5074 16 V 4.3835 7.4032 111.4415 58.8005 33.2775 173.7432 17 P 4.5796 0.0000 0.0000 62.1877 32.0239 176.6694 18 E 4.0101 8.8356 118.6866 58.5247 29.4740 177.9068 19 W 4.7679 8.0508 116.9891 54.8724 31.3727 175.2075 20 V 4.6673 8.2867 114.3660 59.8816 35.3428 174.6250 21 R 4.7299 8.3845 119.3593 54.3640 32.6759 175.6861 22 I 4.4994 7.4841 113.0719 59.2336 40.2919 175.6429 23 G 3.7920 7.3217 107.7293 45.8367 0.0000 172.3111 24 F 4.9742 8.4764 116.7903 55.6118 42.1793 174.5823 25 S 4.7091 8.4444 116.1424 56.6746 65.4277 173.0357 26 A 4.6188 8.1451 127.1738 51.0939 21.8562 175.4458 27 T 4.7647 8.0223 109.7164 60.1155 72.0924 172.7998 28 T 4.9801 8.2782 111.0902 60.1409 73.2812 175.4190 29 G 4.2716 8.5641 112.5646 45.4972 0.0000 175.2284 30 A 4.1360 9.2350 127.7231 53.8167 18.6078 178.0529 31 E 4.6151 7.8675 114.6361 55.0381 31.9743 174.2346 32 F 5.1360 7.1838 113.3724 56.4879 40.4160 172.8201 33 A 4.3690 8.0408 121.0126 51.5629 21.3054 175.8431 34 A 4.3768 8.4215 122.8499 51.7546 19.6833 177.2039 35 H 4.8288 8.5551 117.4379 54.0964 31.6778 173.0209 36 E 4.7080 8.5399 122.6840 54.3820 33.4683 174.9998 37 V 4.2508 8.0240 119.7352 61.1530 34.1482 175.2418 38 L 4.4982 8.4075 125.7516 56.0880 42.9597 176.6194 39 S 4.7884 7.5530 109.6212 57.1819 65.4752 173.3155 40 W 5.5606 8.6261 130.2919 56.2218 33.5437 173.3744 41 Y 4.7701 8.9952 125.4278 55.6530 41.2114 174.1835 42 F 4.4111 7.1614 126.5602 56.4786 42.6273 173.2096 43 H 4.4052 7.1246 125.5499 54.3018 32.5022 172.3943 44 S 4.5867 7.8974 120.1709 56.3789 66.0164 173.0716 45 E 4.5234 8.1700 117.9060 54.9662 31.9878 174.1955 46 L 4.5365 8.2743 123.9631 52.7455 44.5254 175.7178 47 A 4.2005 8.6162 129.1679 52.1515 19.2552 177.2036 48 G 3.7537 8.3042 108.7538 46.4424 0.0000 173.5078 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 2 T 8.17 4.29 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 1.20 0.00 0.00 3 S 8.05 4.67 0.00 3.82 3.74 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 0.00 0.00 0.00 0.00 4 Y 9.09 4.73 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 5 T 8.20 4.78 4.27 0.00 0.00 0.00 0.00 0.00 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 6 L 8.25 4.32 0.00 1.58 1.54 0.94 0.92 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 7 N 8.51 5.03 0.00 2.69 2.67 0.00 0.00 6.96 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 8 E 8.26 4.59 0.00 1.92 1.77 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 2.21 2.36 0.00 9 V 8.26 4.20 2.11 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 0.93 0.00 0.00 0.95 0.00 0.00 10 V 8.18 4.51 2.17 0.00 0.00 0.00 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 1.11 0.00 0.00 11 P 0.00 4.56 0.00 2.10 2.23 0.00 4.01 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.99 0.00 12 L 8.44 4.06 0.00 1.72 1.83 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.95 3.89 0.00 1.82 1.89 0.00 1.49 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.39 7.81 14 E 7.74 3.86 0.00 1.16 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 2.12 2.14 0.00 15 F 7.49 4.86 0.00 3.09 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 16 V 7.40 4.38 2.13 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 0.82 0.00 0.00 0.99 0.00 0.00 17 P 0.00 4.58 0.00 2.30 2.06 0.00 3.73 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 2.08 2.15 0.00 18 E 8.84 4.01 0.00 2.03 1.85 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 2.27 2.34 0.00 19 W 8.05 4.77 0.00 3.21 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 20 V 8.29 4.67 2.11 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 0.81 0.00 0.00 0.95 0.00 0.00 21 R 8.38 4.73 0.00 1.76 1.80 0.00 3.15 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 22 I 7.48 4.50 1.75 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.45 0.76 0.00 0.00 23 G 7.32 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 24 F 8.48 4.97 0.00 2.81 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 25 S 8.44 4.71 0.00 3.76 3.66 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 26 A 8.15 4.62 1.02 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 0.00 0.00 27 T 8.02 4.76 4.24 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 1.20 0.00 0.00 28 T 8.28 4.98 4.55 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 1.37 0.00 0.00 29 G 8.56 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.24 4.14 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.87 4.62 0.00 1.99 1.74 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 0.00 2.12 2.21 0.00 32 F 7.18 5.14 0.00 3.02 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 33 A 8.04 4.37 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.42 4.38 1.23 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 0.00 0.00 0.00 35 H 8.56 4.83 0.00 3.02 3.10 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.54 4.71 0.00 1.84 1.74 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 0.00 2.17 2.24 0.00 37 V 8.02 4.25 1.79 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 0.39 0.00 0.00 0.16 0.00 0.00 38 L 8.41 4.50 0.00 1.64 1.71 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.55 4.79 0.00 4.06 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 40 W 8.63 5.56 0.00 3.29 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 9.00 4.77 0.00 3.04 2.94 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 42 F 7.16 4.41 0.00 2.37 2.31 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 43 H 7.12 4.41 0.00 2.97 2.95 0.00 5.92 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.90 4.59 0.00 3.91 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 45 E 8.17 4.52 0.00 2.02 1.87 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 2.13 2.26 0.00 46 L 8.27 4.54 0.00 1.44 1.45 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.62 4.20 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 G 8.30 3.75 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 0.00 0.00 0.00