NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9310 8.3549 109.7374 44.5185 0.0000 173.8830 3 N 4.0319 8.2195 117.2131 52.3907 38.9138 169.4597 4 V 3.5700 8.5490 122.0788 63.7040 33.3273 172.8429 5 Q 4.0764 9.4631 126.3466 54.4208 29.5853 174.3029 6 T 3.5888 8.0530 114.9836 62.1811 65.5185 172.4567 7 S 4.5503 7.6113 113.2582 58.5853 66.1422 175.4317 8 V 3.6701 8.0817 121.9528 65.9123 31.4486 176.2100 9 N 5.0632 7.8213 115.6685 50.0707 40.9150 176.9944 10 T 3.7493 8.5351 112.7427 62.9655 68.8804 173.3679 11 Y 4.9620 7.8263 119.3984 56.4887 41.7513 174.6513 12 N 4.8096 8.7364 121.0620 52.5372 39.9694 175.3879 13 I 3.9143 8.3660 121.5203 64.4353 38.3470 177.6510 14 T 4.2534 7.9092 106.2736 61.7262 68.7487 174.4789 15 G 3.9580 7.3248 111.3657 45.6239 0.0000 173.0123 16 D 4.2977 8.6496 119.4088 55.4079 41.7982 176.3753 17 G 3.9992 8.6653 114.6667 46.6468 0.0000 172.5065 18 N 4.5609 7.9316 115.7436 52.9949 40.3456 175.0862 19 S 4.4217 7.8055 107.9304 58.0111 63.7052 175.5458 20 F 4.1412 8.9724 129.0267 58.2469 39.6065 175.2598 21 T 4.0134 6.8801 117.1675 60.5909 68.1999 170.2921 22 P 4.1578 0.0000 0.0000 62.1903 32.4930 175.9847 23 T 4.5201 8.0380 115.1726 59.8839 69.7129 174.8251 24 S 4.2181 8.8765 123.6469 60.8544 63.0265 175.0647 25 D 4.4110 7.8691 120.2171 56.4799 41.0572 176.2220 26 M 4.4611 7.1693 116.7065 56.8377 32.4959 177.0022 27 T 3.6071 7.1138 112.6354 62.4591 64.7887 172.4609 28 S 3.8571 8.6158 121.8383 59.7709 63.1596 175.7983 *29 T 4.2010 8.3593 113.0265 60.4267 70.8198 170.6297 30 A 4.3062 7.9489 124.4318 52.3037 18.9861 178.6048 31 A 4.6006 8.4513 116.1373 50.8436 19.5532 173.7230 32 P 4.5178 0.0000 0.0000 65.2659 32.5855 179.2005 33 A 4.4808 7.6937 120.8694 51.4552 18.1553 177.5406 34 I 3.7470 7.6901 122.0684 62.7973 37.6534 175.9279 35 D 4.5876 8.5805 125.2685 53.9877 41.5943 175.5991 36 L 4.7702 8.2656 123.2850 53.5241 44.3044 176.9091 37 K 3.8851 7.9608 118.1558 56.4718 32.5476 175.9039 38 P 3.9857 0.0000 0.0000 66.1185 32.2039 178.2915 39 G 3.6141 8.0311 109.3017 47.6519 0.0000 174.7750 40 V 3.7321 7.6726 118.5111 64.8390 31.8018 176.5343 41 L 4.1360 8.2353 121.0837 55.3805 42.3733 176.0218 42 N 4.2732 7.6193 119.9210 52.8740 38.2304 174.0873 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 G 8.35 3.93 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 0.00 0.00 0.00 3 N 8.22 4.03 0.00 2.81 2.81 0.00 0.00 6.93 6.79 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 4 V 8.55 3.57 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.94 0.00 0.00 5 Q 9.46 4.08 0.00 2.31 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.25 1.88 0.00 6 T 8.05 3.59 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 7 S 7.61 4.55 0.00 3.82 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 8 V 8.08 3.67 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 0.74 0.00 0.00 0.93 0.00 0.00 9 N 7.82 5.06 0.00 2.63 2.60 0.00 0.00 6.51 7.22 0.00 0.00 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 T 8.54 3.75 3.44 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 1.02 0.00 0.00 11 Y 7.83 4.96 0.00 2.98 2.78 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 0.00 0.00 0.00 0.00 12 N 8.74 4.81 0.00 2.75 2.89 0.00 0.00 6.98 7.45 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 13 I 8.37 3.91 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.37 0.93 0.00 0.00 14 T 7.91 4.25 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 15 G 7.32 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 0.00 0.00 0.00 16 D 8.65 4.30 0.00 2.67 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 17 G 8.67 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.93 4.56 0.00 2.73 2.79 0.00 0.00 7.05 7.57 0.00 0.00 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 S 7.81 4.42 0.00 3.90 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.97 4.14 0.00 3.02 3.04 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 0.00 0.00 0.00 21 T 6.88 4.01 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 22 P 0.00 4.16 0.00 2.01 1.87 0.00 3.46 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.62 0.00 23 T 8.04 4.52 4.18 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 0.00 0.00 0.00 1.14 0.00 0.00 24 S 8.88 4.22 0.00 4.00 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 25 D 7.87 4.41 0.00 2.66 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.17 4.46 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 27 T 7.11 3.61 4.23 0.00 0.00 0.00 0.00 0.00 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 28 S 8.62 3.86 0.00 3.97 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 *29 T 8.36 4.20 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 30 A 7.95 4.31 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.45 4.60 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.52 0.00 2.23 2.30 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 33 A 7.69 4.48 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 3.75 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 1.18 0.58 0.91 0.00 0.00 35 D 8.58 4.59 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.77 0.00 1.61 1.62 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.96 3.89 0.00 1.86 1.75 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 38 P 0.00 3.99 0.00 2.22 2.24 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 39 G 8.03 3.61 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 0.00 0.00 0.00 40 V 7.67 3.73 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.98 0.00 0.00 41 L 8.24 4.14 0.00 1.81 1.67 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 42 N 7.62 4.27 0.00 2.97 3.07 0.00 0.00 6.79 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.