NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1387 8.0093 120.7867 61.0065 39.1796 174.5049 2 T 4.4950 8.2570 115.6498 59.3281 71.2407 171.6409 3 A 4.7151 8.8928 126.1730 50.0803 23.3285 177.2861 4 K 4.2135 8.3830 119.0288 55.5353 32.8122 175.6200 5 P 4.3505 0.0000 0.0000 61.9119 31.8591 176.5213 6 A 3.9830 8.5658 123.1497 52.8097 18.5499 178.1477 7 K 4.1499 8.8551 123.1464 59.2663 32.7523 177.7955 8 T 4.6352 7.3118 106.4383 58.3212 68.3367 171.2644 9 P 4.0772 0.0000 0.0000 64.2292 32.3127 176.6393 10 T 5.2104 8.4116 118.4705 60.9667 68.8416 175.1597 11 S 4.3589 8.3778 122.0158 57.3935 65.1047 172.9099 12 P 4.2973 0.0000 0.0000 65.7619 30.9730 178.8765 13 K 3.9009 7.9453 117.7527 59.6460 32.2571 178.6105 14 E 4.0036 8.0942 118.6405 59.5025 29.2550 179.4093 15 Q 3.9785 8.6767 118.3062 58.7662 28.7150 178.6014 16 A 3.9100 8.2431 122.0687 55.0775 18.4157 179.7451 17 I 3.7055 7.8707 118.3677 64.4907 37.1764 178.6343 18 G 3.7648 8.1159 106.4942 47.9254 0.0000 175.0634 19 L 3.8734 8.0540 122.8415 57.9483 42.0808 178.9024 20 S 4.0463 8.0158 114.9386 61.8856 62.8627 177.1784 21 V 3.6388 8.3273 120.8352 66.2220 31.0168 178.1862 22 T 4.0013 8.2183 115.6496 66.8721 68.3546 176.5396 23 F 4.2377 9.1547 119.9572 60.8654 38.9900 177.8714 24 L 4.1965 8.4664 118.7551 57.6989 41.1511 179.6665 25 S 4.2649 8.1411 113.5691 61.0591 61.7736 176.0728 26 F 4.3827 8.2726 120.1668 59.8409 38.7544 177.7276 27 L 4.4765 7.8835 118.2099 57.1410 41.5781 179.3671 28 L 4.0537 8.1013 118.9578 57.4318 41.8261 177.7422 29 P 4.2997 0.0000 0.0000 65.3955 31.3705 178.4914 30 A 4.1962 7.6664 118.0240 55.2826 18.3119 179.5765 31 G 3.8910 8.4637 104.5719 48.0635 0.0000 175.4400 32 W 4.1604 8.7397 131.0177 60.2135 30.5009 178.3146 33 V 3.9376 7.8947 116.6637 66.1219 31.4848 177.6581 34 L 4.1676 8.5838 119.2143 57.9631 41.2425 178.7493 35 Y 3.9287 8.4115 118.8305 60.7509 39.0838 177.1250 36 H 4.1433 7.4745 114.3015 55.4996 28.8486 176.8387 37 L 3.7995 7.2219 123.7232 58.0787 41.1876 178.9812 38 D 4.2270 7.5764 116.2925 57.2637 41.2894 177.5252 39 N 4.4203 7.4286 115.1795 55.3008 38.5496 176.7968 40 Y 4.6093 7.1936 117.6215 60.3727 38.5916 176.5746 41 K 3.3262 8.0779 111.1343 60.4153 31.8376 177.9119 42 K 4.2654 8.5708 133.6634 56.3751 31.8628 176.3699 43 S 4.2397 8.1906 120.5404 58.9265 63.7102 175.1245 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 I 8.01 4.14 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 1.35 0.91 0.00 0.00 2 T 8.26 4.49 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 1.21 0.00 0.00 3 A 8.89 4.72 1.20 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 0.00 0.00 4 K 8.38 4.21 0.00 1.76 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 5 P 0.00 4.35 0.00 2.04 1.98 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 6 A 8.57 3.98 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 7 K 8.86 4.15 0.00 1.76 1.89 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.43 7.81 8 T 7.31 4.64 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 1.21 0.00 0.00 9 P 0.00 4.08 0.00 2.05 2.06 0.00 3.64 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 10 T 8.41 5.21 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 1.24 0.00 0.00 11 S 8.38 4.36 0.00 4.04 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 12 P 0.00 4.30 0.00 2.16 2.14 0.00 3.59 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 13 K 7.95 3.90 0.00 1.78 1.79 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.47 7.81 14 E 8.09 4.00 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 2.35 0.00 15 Q 8.68 3.98 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 16 A 8.24 3.91 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.87 3.71 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.59 0.91 0.00 0.00 18 G 8.12 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 0.00 0.00 0.00 19 L 8.05 3.87 0.00 1.78 1.69 0.62 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.02 4.05 0.00 4.06 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.33 3.64 2.12 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 1.07 0.00 0.00 1.00 0.00 0.00 22 T 8.22 4.00 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 23 F 9.15 4.24 0.00 2.95 3.12 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 24 L 8.47 4.20 0.00 1.94 1.79 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.14 4.26 0.00 4.04 4.19 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.27 4.38 0.00 3.19 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.88 4.48 0.00 1.76 1.78 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.10 4.05 0.00 1.75 1.76 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.30 0.00 2.19 2.09 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.13 0.00 30 A 7.67 4.20 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.46 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 0.00 0.00 0.00 32 W 8.74 4.16 0.00 3.52 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.89 3.94 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.38 0.00 0.00 34 L 8.58 4.17 0.00 2.08 1.75 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.41 3.93 0.00 2.91 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 36 H 7.47 4.14 0.00 2.51 2.26 0.00 5.88 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.22 3.80 0.00 1.70 1.65 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.58 4.23 0.00 2.43 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.43 4.42 0.00 2.47 2.76 0.00 0.00 7.07 6.87 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 40 Y 7.19 4.61 0.00 3.08 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 41 K 8.08 3.33 0.00 1.92 1.66 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.61 7.81 42 K 8.57 4.27 0.00 1.69 1.75 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.51 7.81 43 S 8.19 4.24 0.00 4.19 3.74 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