NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 S 4.3421 8.3231 115.2913 58.2068 64.2419 173.8038 16 G 3.7651 7.6844 107.0589 43.6581 0.0000 170.8621 17 N 4.6277 9.2082 117.1407 53.6035 39.1034 174.3255 18 E 4.6785 7.9727 117.2687 54.8767 32.1516 176.8798 19 G 4.1322 8.6272 114.9836 45.1478 0.0000 171.9617 20 V 4.2228 7.7987 119.6055 60.4737 32.2321 174.7524 21 I 3.7228 8.1265 128.9523 64.9945 37.3325 178.5928 22 I 3.9438 7.6634 117.6328 62.1654 36.8127 178.0642 23 N 4.7802 9.1490 120.2900 52.9568 36.0861 174.7952 24 N 4.6014 8.1195 114.2324 56.3619 39.2958 179.2566 25 F 3.0187 7.6417 116.5121 59.1417 41.9497 174.5719 26 Y 4.2469 8.3077 121.9997 56.7078 38.8524 176.3548 27 S 4.1701 8.6866 118.5170 58.6849 64.2200 174.2782 28 N 4.2282 8.9951 126.2832 57.4128 38.4317 176.8385 29 Q 4.0624 7.7829 118.3598 58.5949 29.1403 177.0135 30 Y 4.1384 7.8396 116.5388 60.4735 38.6444 177.1207 31 Q 4.1483 8.5899 119.7064 57.6831 29.4958 175.8505 32 N 5.0956 7.5324 115.5066 50.5921 42.6371 174.2660 33 S 4.0730 8.6288 115.4428 58.7717 63.3151 174.1775 34 I 3.9161 8.1255 124.6313 60.8125 37.1097 175.3944 35 D 4.5490 8.5709 126.5072 53.7766 41.2573 175.8029 36 L 4.5438 8.1556 125.1152 53.3488 45.1657 174.9527 37 S 4.4337 8.6953 120.3655 57.1589 62.3480 173.3473 38 A 3.9161 8.3840 130.9908 55.6814 18.7086 177.0792 39 S 4.2955 7.8806 113.4280 58.5238 62.9958 174.1867 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 15 S 8.32 4.34 0.00 3.85 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 16 G 7.68 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 0.00 0.00 0.00 17 N 9.21 4.63 0.00 2.68 2.79 0.00 0.00 6.65 7.65 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 18 E 7.97 4.68 0.00 1.96 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 19 G 8.63 4.13 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 0.00 0.00 0.00 20 V 7.80 4.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.94 0.00 0.00 21 I 8.13 3.72 1.88 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 1.42 0.69 0.92 0.00 0.00 22 I 7.66 3.94 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 1.47 0.73 0.93 0.00 0.00 23 N 9.15 4.78 0.00 2.88 3.26 0.00 0.00 6.61 7.92 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 24 N 8.12 4.60 0.00 2.91 3.08 0.00 0.00 5.93 8.12 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 25 F 7.64 3.02 0.00 2.90 3.20 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 0.00 0.00 0.00 26 Y 8.31 4.25 0.00 3.26 2.89 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 27 S 8.69 4.17 0.00 3.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.00 4.23 0.00 2.83 2.89 0.00 0.00 6.80 6.78 0.00 0.00 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 Q 7.78 4.06 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.64 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 30 Y 7.84 4.14 0.00 3.15 3.01 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 0.00 0.00 0.00 31 Q 8.59 4.15 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 32 N 7.53 5.10 0.00 2.82 2.64 0.00 0.00 7.00 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 33 S 8.63 4.07 0.00 3.95 3.87 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 0.00 0.00 0.00 34 I 8.13 3.92 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 0.89 0.00 0.00 35 D 8.57 4.55 0.00 2.66 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.16 4.54 0.00 1.52 1.46 0.91 0.94 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 37 S 8.70 4.43 0.00 3.86 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.38 3.92 1.28 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 0.00 0.00 0.00 39 S 7.88 4.30 0.00 3.99 3.87 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 0.00 0.00 0.00