NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2047 8.2649 123.5720 52.2273 19.8867 175.7848 2 C 5.0933 7.9372 114.9735 55.3152 42.7098 171.8796 3 Y 4.8769 9.8611 118.1495 56.9582 43.1239 173.2903 4 C 5.5561 8.7678 118.6374 55.5593 40.8650 173.6564 5 R 5.2670 9.6570 122.7752 54.3735 33.9379 174.4851 6 A 5.1744 8.8297 122.8400 49.8285 21.4712 174.5561 7 P 4.3381 0.0000 0.0000 64.1798 32.2015 175.3356 8 A 4.5850 7.3671 119.8224 51.1014 21.9534 176.1718 9 C 4.5503 8.5361 117.1767 57.0231 42.2177 174.1975 10 I 4.1891 8.1730 115.3080 59.4724 38.5918 175.1319 11 A 4.0859 8.3749 124.4936 54.3878 18.3873 178.1206 12 G 4.0532 9.1470 110.6885 44.8700 0.0000 173.1788 13 E 4.8431 7.8681 118.8905 54.5170 31.9245 175.5799 14 R 4.4095 8.6461 122.4124 54.9518 32.2861 175.5928 15 R 4.4808 8.2828 123.3566 56.3638 30.5315 175.4263 16 Y 4.4642 10.2338 123.3251 57.0893 39.1286 177.3429 17 G 4.1108 7.0474 106.4801 46.1986 0.0000 170.8162 18 T 5.2476 8.1042 117.2855 62.1603 72.0227 174.6916 19 C 4.7389 9.5402 123.9231 56.1896 42.5314 172.9828 20 I 5.1235 8.2869 122.1673 60.2214 39.0858 174.4510 21 Y 4.9249 9.5482 127.4975 57.6357 41.9027 174.4694 22 Q 2.9766 9.3400 123.3822 56.8524 26.4873 174.0450 23 G 3.9870 8.5159 101.6620 46.5208 0.0000 174.3699 24 R 4.6203 8.0281 116.8538 53.9144 34.0737 174.2413 25 L 5.3232 8.0471 119.5161 53.7475 43.3233 176.0219 26 W 5.3805 9.1434 120.7151 54.7395 34.4003 174.1978 27 A 4.5517 9.3136 124.6825 52.0635 19.3587 176.4145 28 F 5.3979 9.3015 125.7582 57.5175 40.9038 173.9142 29 C 5.5007 9.4636 123.7557 55.3590 44.5825 173.7355 30 C 4.7666 9.2285 119.4829 57.2368 42.0578 173.9511 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 A 8.26 4.20 1.12 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 0.00 0.00 2 C 7.94 5.09 0.00 2.95 3.08 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 3 Y 9.86 4.88 0.00 2.88 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.77 5.56 0.00 2.27 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 9.66 5.27 0.00 1.82 1.98 0.00 3.13 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 6 A 8.83 5.17 1.03 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 7 P 0.00 4.34 0.00 2.19 2.17 0.00 3.83 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 1.98 1.96 0.00 8 A 7.37 4.59 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 9 C 8.54 4.55 0.00 2.98 3.05 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 0.00 0.00 0.00 0.00 10 I 8.17 4.19 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.88 0.00 0.00 11 A 8.37 4.09 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 12 G 9.15 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.87 4.84 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 14 R 8.65 4.41 0.00 1.64 1.35 0.00 3.06 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 15 R 8.28 4.48 0.00 1.79 1.76 0.00 3.25 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 16 Y 10.23 4.46 0.00 2.21 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 17 G 7.05 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 18 T 8.10 5.25 4.33 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 1.34 0.00 0.00 19 C 9.54 4.74 0.00 3.07 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.29 5.12 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 1.00 0.00 0.00 21 Y 9.55 4.92 0.00 2.84 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.34 2.98 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.50 0.00 0.00 0.00 0.00 0.00 1.81 1.16 0.00 23 G 8.52 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.03 4.62 0.00 1.81 1.18 0.00 2.51 0.00 0.00 2.95 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.63 0.00 25 L 8.05 5.32 0.00 1.48 1.63 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 26 W 9.14 5.38 0.00 3.28 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.31 4.55 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.30 5.40 0.00 3.13 3.13 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 0.00 0.00 0.00 0.00 29 C 9.46 5.50 0.00 2.99 3.03 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 30 C 9.23 4.77 0.00 2.68 2.74 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