NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 I 3.8049 8.0249 120.7657 60.6399 38.9735 174.8833 30 N 4.2752 8.3515 125.7637 52.1704 38.1628 173.3635 31 Y 4.1913 8.7839 122.3682 58.6545 39.6741 175.0706 32 Y 4.8752 7.3780 117.7676 55.6256 40.4763 176.3915 33 K 4.2174 8.9755 123.6703 58.1588 32.6779 175.6885 34 D 5.1397 7.6905 117.5174 53.7629 43.7683 174.1642 35 A 4.4562 8.5143 119.6704 54.4330 20.4718 179.5529 36 A 4.1190 8.0069 117.6939 55.0869 18.8699 178.5694 37 S 4.0568 8.2563 111.0306 62.0645 63.0543 175.4891 38 T 4.0943 7.2126 111.8571 61.7845 67.5653 173.8332 39 S 4.5611 8.2439 121.2239 56.6343 64.7809 173.4459 40 S 4.1196 8.4493 114.5921 58.8889 61.8210 172.5649 41 A 4.2004 7.7423 125.5464 51.3736 19.7059 177.7592 42 G 3.7108 8.7578 100.2707 44.2197 0.0000 173.1646 43 Q 3.4502 7.6563 118.3482 54.7591 28.2621 176.7376 44 S 4.1449 8.8899 121.0553 61.2096 62.6284 175.5502 45 L 3.7600 7.7615 117.3498 56.9608 39.5563 176.0552 46 S 4.1695 8.3549 114.4796 62.3471 63.6004 175.6467 47 M 2.9440 7.8571 116.5297 56.5266 28.3461 176.1324 48 D 4.6722 8.2555 123.3566 51.5524 42.4916 173.5331 49 P 4.5012 0.0000 0.0000 66.6316 31.5528 182.0361 50 S 3.4073 7.3139 111.0244 60.1766 64.4003 175.8316 51 K 3.7422 7.3266 119.1611 58.8858 32.1337 177.4620 52 F 4.8061 8.9526 115.8527 58.7820 41.3145 176.8190 53 T 4.1068 8.3464 109.5363 64.5162 69.2806 174.8274 54 E 4.7904 8.3722 120.8757 54.2882 30.4979 175.4343 55 P 4.7733 0.0000 0.0000 62.3356 31.1539 177.6406 56 V 3.8419 7.8181 112.8802 61.9345 31.7512 176.4117 57 K 3.9364 8.0413 126.0155 59.1452 32.6443 176.8167 58 D 4.4401 7.6864 128.9053 53.8545 40.1370 176.0400 59 L 4.0985 8.2639 126.4635 55.0449 42.8417 175.9812 60 M 4.5559 8.3987 124.6797 53.5183 33.6801 175.0532 61 L 4.4736 8.1334 124.5273 53.1349 43.7033 175.2087 62 K 4.1922 8.4559 127.3907 57.6912 32.3116 176.4416 63 G 4.0767 9.0493 113.5246 45.1413 0.0000 172.6675 64 A 4.6543 7.2785 120.9566 49.0120 21.3741 174.1528 65 P 4.0842 0.0000 0.0000 63.6578 30.7246 176.5793 66 A 3.4911 7.4730 124.0626 54.1411 19.5471 176.4668 67 L 4.6836 7.4101 115.7661 52.9437 43.2198 176.5514 68 N 4.4904 8.8971 120.1301 52.9920 37.1847 174.7109 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 29 I 8.02 3.80 1.73 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.23 0.38 0.00 0.00 30 N 8.35 4.28 0.00 2.73 2.69 0.00 0.00 7.11 6.57 0.00 0.00 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 8.78 4.19 0.00 2.28 2.68 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 32 Y 7.38 4.88 0.00 3.13 2.88 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 33 K 8.98 4.22 0.00 1.79 1.93 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.50 7.81 34 D 7.69 5.14 0.00 2.63 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 35 A 8.51 4.46 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.01 4.12 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.26 4.06 0.00 4.08 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 0.00 38 T 7.21 4.09 4.28 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 1.19 0.00 0.00 39 S 8.24 4.56 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.45 4.12 0.00 3.86 3.84 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 0.00 0.00 0.00 41 A 7.74 4.20 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.76 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.66 3.45 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 44 S 8.89 4.14 0.00 3.88 3.88 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 45 L 7.76 3.76 0.00 1.96 1.86 0.93 0.82 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 46 S 8.35 4.17 0.00 3.90 3.96 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 47 M 7.86 2.94 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 48 D 8.26 4.67 0.00 2.56 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.31 2.18 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 50 S 7.31 3.41 0.00 4.31 3.96 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 51 K 7.33 3.74 0.00 0.79 0.91 0.00 1.33 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.20 1.29 7.81 52 F 8.95 4.81 0.00 2.94 3.07 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 53 T 8.35 4.11 4.29 0.00 0.00 0.00 0.00 0.00 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 54 E 8.37 4.79 0.00 2.00 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 2.23 2.25 0.00 55 P 0.00 4.77 0.00 2.14 2.11 0.00 3.52 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.25 0.00 56 V 7.82 3.84 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.98 0.00 0.00 57 K 8.04 3.94 0.00 1.71 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 58 D 7.69 4.44 0.00 2.70 2.65 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 0.00 0.00 0.00 0.00 59 L 8.26 4.10 0.00 1.58 1.56 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 60 M 8.40 4.56 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 61 L 8.13 4.47 0.00 1.63 1.51 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.46 4.19 0.00 1.76 1.71 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.44 7.81 63 G 9.05 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.28 4.65 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 65 P 0.00 4.08 0.00 2.05 2.06 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 66 A 7.47 3.49 1.24 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 0.00 0.00 0.00 67 L 7.41 4.68 0.00 1.68 1.62 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 68 N 8.90 4.49 0.00 2.83 2.85 0.00 0.00 6.13 7.56 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