NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9767 8.3544 109.7435 45.9808 0.0000 172.3192 2 I 4.0798 7.6924 114.5661 60.2982 43.7850 171.3912 3 V 3.5910 7.8845 119.3009 65.4440 32.1760 176.9644 4 E 3.9052 8.0307 118.0754 59.3359 29.6697 178.4523 5 Q 4.1413 8.0455 115.5217 58.6014 29.2787 177.8365 6 C 4.6488 7.5159 117.8125 58.4436 41.0903 174.6133 7 C 4.2554 8.4632 117.7522 60.7494 31.1832 174.5964 8 T 4.2780 7.6694 113.2417 64.3963 67.3608 175.7490 9 S 4.5954 7.1865 114.7879 58.0718 64.8491 172.0120 10 I 3.5347 7.6853 124.2402 61.3396 37.2069 172.8684 11 C 4.7952 8.3324 120.3410 55.2028 36.6333 173.4237 12 S 4.4816 8.3059 115.0522 57.5955 63.1875 174.5475 13 L 3.8550 8.4034 126.0536 58.6959 41.5177 179.0840 14 Y 4.3215 7.4067 114.4737 60.9028 37.9378 178.0699 15 Q 4.1715 7.9579 119.0055 58.9029 28.7781 178.5090 16 L 4.2937 7.9349 119.5827 57.8093 41.7480 179.0806 17 E 3.9785 8.1317 118.0506 59.3472 29.1317 178.8057 18 N 4.3825 7.6759 115.1463 54.9471 38.6366 175.1543 19 Y 4.6579 7.5301 116.4844 57.6978 39.1057 175.6685 20 C 4.3896 7.5863 120.2724 59.0679 32.3793 172.7381 21 N 4.5900 8.5291 122.1178 53.7630 38.8225 174.0103 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 G 8.35 3.98 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 0.00 0.00 0.00 2 I 7.69 4.08 0.89 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.48 0.68 0.00 0.00 3 V 7.88 3.59 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 1.03 0.00 0.00 0.85 0.00 0.00 4 E 8.03 3.91 0.00 1.98 1.95 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 2.28 2.31 0.00 5 Q 8.05 4.14 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.01 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 6 C 7.52 4.65 0.00 2.87 3.14 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 0.00 0.00 0.00 0.00 7 C 8.46 4.26 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.67 4.28 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 1.30 0.00 0.00 9 S 7.19 4.60 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 3.53 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 1.29 0.21 0.91 0.00 0.00 11 C 8.33 4.80 0.00 2.99 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 12 S 8.31 4.48 0.00 3.89 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.40 3.86 0.00 1.56 1.07 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.41 4.32 0.00 3.02 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.96 4.17 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 16 L 7.93 4.29 0.00 1.85 1.80 0.93 1.05 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 17 E 8.13 3.98 0.00 2.24 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 2.49 2.57 0.00 18 N 7.68 4.38 0.00 2.01 2.43 0.00 0.00 6.86 7.58 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 19 Y 7.53 4.66 0.00 3.10 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 20 C 7.59 4.39 0.00 2.97 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 21 N 8.53 4.59 0.00 2.70 2.63 0.00 0.00 6.90 7.58 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