NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 C 4.5280 8.3331 118.3640 59.9179 29.5662 172.4880 4 G 3.8068 8.8818 113.2664 46.2864 0.0000 173.4460 5 G 4.2353 7.7426 109.2144 44.0637 0.0000 173.4574 6 V 3.5839 8.1178 121.2002 65.7049 31.6049 176.9904 7 Q 3.9623 8.0357 117.1232 58.8412 28.6558 178.4439 8 A 3.9762 7.9118 121.2228 55.3306 18.4844 179.4335 9 E 3.9259 8.2196 117.1307 59.4321 29.5010 179.2703 10 E 3.9080 8.7243 119.7976 59.3049 29.8575 178.6216 11 Q 3.9629 8.7962 120.3633 58.9510 29.0424 178.2003 12 K 4.0079 8.0767 120.7865 59.2171 32.2231 178.8306 13 L 4.0387 8.1282 119.4703 57.7362 41.4820 179.5902 14 I 3.6807 7.9085 119.6491 64.6618 37.1676 178.6475 15 S 4.1348 7.8983 115.4418 61.6265 62.4843 176.5668 16 E 3.9358 8.6960 122.4691 59.1024 29.3858 178.5163 17 E 3.9127 8.5213 119.9125 59.3506 29.7643 178.2774 18 D 4.3523 8.7807 118.4435 57.0567 41.0666 177.9807 19 L 3.9464 7.8009 121.0107 58.2215 42.0773 179.0619 20 L 4.0273 7.7577 118.8811 57.7002 41.4574 179.7072 21 R 3.9058 7.9555 118.3172 59.0871 29.8460 178.9624 22 K 3.9788 8.1360 119.5289 59.4445 32.1223 178.9010 23 R 3.9418 7.7598 119.3099 59.1681 30.0141 178.3886 24 R 3.9446 8.1625 118.8409 59.2873 30.0153 178.4803 25 E 3.8857 8.0392 118.1437 59.3699 29.5247 179.2471 26 Q 4.0908 7.8800 118.0152 59.0012 28.6551 178.8532 27 L 4.0088 8.3230 120.4618 57.7129 41.5966 179.5351 28 K 3.9891 8.1819 119.5571 59.3830 31.9808 178.7132 29 H 4.2300 8.4501 117.0768 58.9673 28.7078 177.9137 30 K 3.6665 8.1279 120.1737 59.3190 31.5812 179.2469 31 L 4.1730 7.3915 121.4345 57.2696 42.0907 178.3679 32 E 4.0618 8.5172 118.9221 59.3862 29.7719 178.1953 33 Q 4.1508 8.7923 119.4156 58.4522 29.4911 175.9012 34 L 4.3579 8.0663 124.3024 54.8547 42.7799 175.9834 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 3 C 8.33 4.53 0.00 2.98 2.95 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 4 G 8.88 3.81 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 0.00 0.00 0.00 5 G 7.74 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 0.00 0.00 0.00 0.00 6 V 8.12 3.58 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 1.02 0.00 0.00 0.93 0.00 0.00 7 Q 8.04 3.96 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 8 A 7.91 3.98 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 9 E 8.22 3.93 0.00 2.18 2.01 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 2.33 2.39 0.00 10 E 8.72 3.91 0.00 2.13 1.94 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 2.30 2.31 0.00 11 Q 8.80 3.96 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 12 K 8.08 4.01 0.00 2.00 1.89 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 13 L 8.13 4.04 0.00 1.93 1.70 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.91 3.68 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.88 0.91 0.00 0.00 15 S 7.90 4.13 0.00 3.89 3.92 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 0.00 0.00 0.00 0.00 16 E 8.70 3.94 0.00 2.15 1.94 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 2.30 2.31 0.00 17 E 8.52 3.91 0.00 2.15 2.04 0.00 0.00 0.00 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 2.31 0.00 18 D 8.78 4.35 0.00 2.82 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 19 L 7.80 3.95 0.00 1.98 1.71 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.76 4.03 0.00 1.81 1.70 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.96 3.91 0.00 2.07 1.97 0.00 3.21 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 22 K 8.14 3.98 0.00 1.97 1.81 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.45 7.81 23 R 7.76 3.94 0.00 1.87 1.99 0.00 3.15 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 24 R 8.16 3.94 0.00 2.03 2.00 0.00 3.14 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 25 E 8.04 3.89 0.00 2.21 1.99 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 2.27 2.33 0.00 26 Q 7.88 4.09 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 27 L 8.32 4.01 0.00 1.69 1.71 0.94 0.48 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 28 K 8.18 3.99 0.00 1.93 1.69 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.45 7.81 29 H 8.45 4.23 0.00 3.41 3.31 0.00 5.68 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 30 K 8.13 3.67 0.00 1.83 1.87 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.47 7.81 31 L 7.39 4.17 0.00 1.77 1.69 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.52 4.06 0.00 2.12 1.98 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 2.33 2.31 0.00 33 Q 8.79 4.15 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 34 L 8.07 4.36 0.00 1.86 1.46 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00