NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.2525 8.0433 122.7539 54.8423 43.8635 175.5319 10 L 4.3110 8.6714 127.2288 53.8514 41.6309 174.6017 11 L 4.9614 8.2767 124.0975 52.6486 45.9068 175.1161 12 E 5.0479 8.3533 117.7178 54.9874 33.3206 175.3811 13 C 5.2267 8.5618 119.9011 59.0869 31.1385 172.1176 14 T 4.4369 8.0278 109.2281 60.5300 69.9733 172.6818 15 E 4.4405 8.4775 126.5931 56.2385 28.9275 178.3264 16 C 4.6126 8.3234 114.3667 58.9960 33.6316 172.8343 17 K 4.0766 7.7243 115.2473 57.9957 35.0004 175.0732 18 R 3.8779 8.6372 116.2539 56.9073 27.9683 177.9122 19 R 3.2928 7.6640 113.1162 57.4883 29.4292 173.3020 20 N 4.8673 8.0865 123.2539 49.7570 44.3332 174.4585 21 Y 5.0776 8.9296 122.9634 59.3535 35.5315 168.3337 22 A 4.6817 8.4018 126.0613 49.9130 18.1640 176.0496 23 T 4.1961 8.1316 110.5013 61.5842 69.5402 174.0133 24 E 4.3467 8.6077 125.8720 54.8129 36.6869 177.8169 25 K 4.1382 8.3635 128.6656 57.0800 34.5038 173.0370 26 N 4.7761 8.3159 126.3020 52.3710 41.0939 174.9522 27 K 4.4403 8.0068 115.5422 55.3292 33.7123 175.3751 28 R 4.6895 7.7589 116.4758 55.2534 34.3077 174.8111 29 N 4.7126 8.5087 114.4246 52.0116 37.4975 175.2138 30 T 4.5530 7.7965 116.8414 61.9207 68.5074 169.3173 31 P 4.0470 0.0000 0.0000 59.1973 33.7410 175.4354 32 N 5.0957 8.6030 125.8882 54.2630 34.3623 174.6689 33 K 4.0179 7.5623 120.0334 55.9405 32.7697 176.5898 34 L 4.2582 8.6504 119.3074 60.5354 38.8252 179.7507 35 E 3.7671 6.8333 119.0892 54.7356 26.7062 176.0330 36 L 4.9975 7.7734 123.5681 53.4967 45.7556 174.3134 37 R 4.7926 8.3379 121.7039 55.0174 34.0536 174.4429 38 K 4.5525 8.7047 121.6555 56.1176 33.4979 175.0053 39 Y 4.2342 9.4828 126.2484 56.4398 41.4283 173.6188 40 C 4.7111 8.0803 120.8669 57.2719 32.9966 172.1146 41 P 3.3447 0.0000 0.0000 62.1486 32.0943 176.1174 42 W 4.6999 6.6291 126.0758 55.2477 27.5146 175.2886 43 C 5.9455 8.0190 130.4217 57.9817 29.3778 174.7081 44 R 4.1988 7.1474 124.8853 55.6804 31.6311 172.9521 45 K 4.0622 9.1866 118.5618 55.3604 33.7030 176.0857 46 H 3.9598 8.6175 113.6053 57.5071 27.1733 174.0567 47 T 4.5692 8.8660 121.5415 63.5657 67.5353 174.9773 48 V 4.0865 8.0697 129.8669 61.1463 34.6181 169.5279 49 H 4.8652 8.3658 122.6541 55.7543 27.9104 174.3460 50 R 4.8295 9.0100 123.5374 53.6220 34.1707 174.8914 51 E 4.4633 8.4654 122.5433 56.5893 30.0713 176.3129 52 V 4.3431 7.8625 126.7707 60.0119 34.8001 176.0240 53 K 5.0395 7.3337 118.6421 55.6965 31.2817 175.8007 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 9 L 8.04 4.25 0.00 1.74 1.61 0.91 0.31 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 10 L 8.67 4.31 0.00 1.63 1.63 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.28 4.96 0.00 1.51 1.50 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.35 5.05 0.00 1.97 2.03 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 2.18 2.26 0.00 13 C 8.56 5.23 0.00 3.14 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 T 8.03 4.44 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 15 E 8.48 4.44 0.00 1.57 1.27 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 2.23 2.15 0.00 16 C 8.32 4.61 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 17 K 7.72 4.08 0.00 1.94 1.90 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.22 1.26 7.81 18 R 8.64 3.88 0.00 1.98 2.16 0.00 3.44 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 19 R 7.66 3.29 0.00 1.79 1.94 0.00 3.43 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 1.62 1.53 0.00 20 N 8.09 4.87 0.00 3.35 3.00 0.00 0.00 6.44 7.55 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 21 Y 8.93 5.08 0.00 2.99 3.37 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 0.00 22 A 8.40 4.68 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 4.20 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 1.37 0.00 0.00 24 E 8.61 4.35 0.00 1.72 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 2.07 2.25 0.00 25 K 8.36 4.14 0.00 1.69 1.65 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.66 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.17 1.26 7.81 26 N 8.32 4.78 0.00 2.84 2.71 0.00 0.00 7.08 6.56 0.00 0.00 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 K 8.01 4.44 0.00 1.72 1.72 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.39 7.81 28 R 7.76 4.69 0.00 1.61 1.88 0.00 3.30 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 29 N 8.51 4.71 0.00 2.79 2.89 0.00 0.00 5.85 7.71 0.00 0.00 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 T 7.80 4.55 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 1.21 0.00 0.00 31 P 0.00 4.05 0.00 2.23 1.98 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 32 N 8.60 5.10 0.00 2.91 3.06 0.00 0.00 6.32 7.13 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 33 K 7.56 4.02 0.00 1.71 1.82 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.51 7.81 34 L 8.65 4.26 0.00 1.78 1.72 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 35 E 6.83 3.77 0.00 2.15 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 2.40 2.58 0.00 36 L 7.77 5.00 0.00 1.57 1.79 0.93 0.92 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 37 R 8.34 4.79 0.00 1.88 1.86 0.00 3.37 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 38 K 8.70 4.55 0.00 1.94 1.86 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.73 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.44 7.81 39 Y 9.48 4.23 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.08 4.71 0.00 2.49 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.34 0.00 1.91 2.05 0.00 3.65 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 1.98 1.89 0.00 42 W 6.63 4.70 0.00 3.57 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.02 5.95 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 44 R 7.15 4.20 0.00 1.88 1.94 0.00 3.16 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.35 0.00 45 K 9.19 4.06 0.00 1.82 2.12 0.00 1.90 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.39 7.81 46 H 8.62 3.96 0.00 3.14 3.32 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.87 4.57 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 1.19 0.00 0.00 48 V 8.07 4.09 2.10 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 1.06 0.00 0.00 0.94 0.00 0.00 49 H 8.37 4.87 0.00 3.53 3.47 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 9.01 4.83 0.00 1.61 1.76 0.00 3.11 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 51 E 8.47 4.46 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 52 V 7.86 4.34 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 0.33 0.00 0.00 53 K 7.33 5.04 0.00 1.71 1.72 0.00 1.97 0.00 0.00 1.85 0.00 0.00 3.16 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.41 1.34 7.81