NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4191 8.1627 120.3488 55.5435 34.4190 177.3876 3 K 4.0925 7.8606 120.4867 58.0831 32.2405 177.0058 4 Q 3.9909 8.1987 119.7337 58.9042 29.4177 177.3294 5 L 3.9674 7.7425 121.1122 58.0814 41.7517 178.5267 6 E 3.9695 8.3192 118.5996 59.5105 29.3023 179.0824 7 D 4.4077 8.1896 118.8591 57.3996 40.8131 179.0582 8 K 3.9805 8.0503 118.9832 59.3482 32.0086 179.6885 9 V 3.5939 8.0271 118.7070 65.9668 31.3768 177.9594 10 E 3.9632 8.5879 118.8502 59.1938 29.2620 178.7245 11 E 3.9305 8.3823 119.5147 59.4502 29.7092 178.9332 12 L 4.0018 8.1888 119.0069 57.8095 41.7190 179.4449 13 L 3.9963 8.4992 119.1488 57.8465 41.6015 179.5235 14 S 4.1207 8.3720 113.1464 61.5598 62.3219 176.4254 15 K 4.0836 8.5471 121.5536 59.3772 31.6629 178.9301 16 N 4.2869 8.7706 117.8123 56.6943 39.0275 176.1373 17 Y 4.0577 8.0589 120.8757 61.2558 38.9359 177.9579 18 H 3.9839 8.3025 116.8950 58.6712 28.7287 177.6344 19 L 3.9177 8.2164 122.4097 58.0775 41.9325 178.5690 20 E 3.8759 8.4010 119.5927 59.4137 29.5449 178.5473 21 N 4.2646 7.7954 116.0757 56.2768 38.4962 177.6354 22 R 3.8932 7.8970 119.4995 59.1138 30.1385 179.2206 23 V 3.5292 8.1362 118.2303 65.9109 31.6374 177.8291 24 A 4.2459 8.4368 122.1111 54.7002 18.3118 179.8089 25 R 3.8641 8.0841 116.4350 59.4486 30.1730 179.2908 26 L 4.0183 7.9068 118.7360 57.8764 41.0518 179.4706 27 E 4.0982 8.3779 118.5694 59.2644 29.1145 179.5811 28 K 4.0306 7.7587 117.6416 59.2221 32.1527 179.2555 29 L 4.1218 7.4916 118.0234 57.8970 41.7814 179.3789 30 V 3.8300 8.1524 117.2460 65.7229 31.5518 175.9566 31 G 3.7345 8.1666 111.4348 45.7575 0.0000 172.9760 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 M 8.16 4.42 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 3 K 7.86 4.09 0.00 1.91 1.78 0.00 1.83 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.36 7.81 4 Q 8.20 3.99 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 5 L 7.74 3.97 0.00 1.80 1.80 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.32 3.97 0.00 2.23 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 2.47 0.00 7 D 8.19 4.41 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.05 3.98 0.00 1.94 1.86 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.59 7.81 9 V 8.03 3.59 2.20 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 1.03 0.00 0.00 1.01 0.00 0.00 10 E 8.59 3.96 0.00 2.14 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 2.52 2.46 0.00 11 E 8.38 3.93 0.00 2.14 2.20 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 2.33 2.38 0.00 12 L 8.19 4.00 0.00 1.89 1.72 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.50 4.00 0.00 1.79 1.72 0.95 0.78 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 14 S 8.37 4.12 0.00 3.90 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 15 K 8.55 4.08 0.00 1.89 1.88 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.61 7.81 16 N 8.77 4.29 0.00 2.84 3.04 0.00 0.00 6.82 7.60 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 17 Y 8.06 4.06 0.00 3.08 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 18 H 8.30 3.98 0.00 3.27 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.22 3.92 0.00 1.86 1.66 0.91 1.16 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 20 E 8.40 3.88 0.00 2.07 1.96 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 2.24 2.31 0.00 21 N 7.80 4.26 0.00 2.73 2.70 0.00 0.00 7.04 6.96 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 22 R 7.90 3.89 0.00 2.03 1.95 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 23 V 8.14 3.53 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 24 A 8.44 4.25 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 3.86 0.00 2.01 1.97 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 26 L 7.91 4.02 0.00 1.87 1.71 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.38 4.10 0.00 2.17 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 2.32 2.46 0.00 28 K 7.76 4.03 0.00 1.95 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.61 7.81 29 L 7.49 4.12 0.00 1.80 1.71 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.15 3.83 2.14 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 0.80 0.00 0.00 0.96 0.00 0.00 31 G 8.17 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 0.00 0.00 0.00