NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 G 3.9706 8.2133 109.7364 45.5130 0.0000 175.6343 7 I 3.5667 7.7145 121.2861 62.6614 37.4271 173.0720 8 V 3.6031 7.8677 118.2917 65.4695 32.1942 177.2778 9 Q 4.0384 7.9756 119.7571 59.2670 28.9588 177.6506 10 Q 3.9696 8.1149 120.0599 59.2080 28.8700 178.0194 11 Q 3.9299 8.2084 120.7490 59.4943 29.0857 178.4673 12 Q 4.0359 8.0432 119.9424 58.8317 29.0237 178.0760 13 Q 3.9615 7.8662 118.9037 59.0386 29.0560 178.4467 14 L 4.0115 8.1461 120.1210 57.6286 41.6320 179.2046 15 L 4.1035 7.7994 119.5567 57.3221 41.9458 178.2534 16 D 4.5549 7.7622 118.3381 56.4576 41.1151 178.7536 17 V 3.5664 7.8436 118.8838 66.1430 31.3596 178.3570 18 V 3.6037 7.7364 117.2071 65.2504 31.4283 178.0372 19 K 4.0242 7.5364 118.4784 59.5139 32.1029 179.0891 20 R 4.8418 8.2565 120.1141 59.0425 29.9871 179.0892 21 Q 4.0584 8.3834 118.0096 58.8498 28.6180 178.7225 22 Q 3.9649 7.7690 119.5102 59.2113 28.7529 178.1327 23 E 4.0107 7.7790 118.4852 59.1780 29.5001 179.0422 24 L 4.0081 7.8863 120.5432 57.8548 42.0331 179.0264 25 L 4.0887 8.0860 119.3120 57.7013 41.6078 179.4536 26 R 3.9803 8.1333 117.8264 58.8794 29.7920 179.1018 27 L 4.1676 7.5999 119.0629 57.7253 41.9119 179.0302 28 T 4.1604 7.9523 108.7611 63.8187 68.8676 176.6712 29 V 4.0467 8.2211 121.7982 65.2024 31.4316 177.6750 30 W 4.1970 8.0207 127.6459 60.2444 30.6452 178.0622 31 G 3.8090 8.6335 105.1167 48.0780 0.0000 175.4543 32 T 4.0157 8.0294 119.7822 65.8849 68.9845 176.0533 33 K 4.0059 7.7131 121.3301 54.7199 32.5224 178.1428 *48 Q 4.5017 8.6610 123.6058 55.5437 30.8402 176.7737 49 E 4.0821 8.1206 117.3834 58.1966 30.2392 178.2734 50 W 4.2727 8.6033 130.6674 61.5079 30.6199 177.6205 *51 E 4.2732 7.9178 113.7853 58.8272 28.6800 179.3342 52 R 4.5511 7.6966 120.2696 58.3740 31.3653 178.3109 53 K 3.9686 7.5819 117.6864 59.2079 32.4011 179.1956 54 V 3.4139 7.4369 116.9968 65.5606 31.2563 177.5283 55 D 4.3377 7.7155 118.2976 57.3387 40.8852 178.4507 56 F 4.2792 7.5854 117.8917 60.4903 38.9233 177.7870 57 L 4.0341 7.9657 118.5421 57.7984 41.1526 179.3086 58 E 4.0647 7.9086 118.2965 58.6567 29.2727 179.0831 59 E 4.1355 8.0382 120.9617 59.5028 30.0405 178.7534 60 N 4.3529 8.2913 119.4416 57.8839 37.7115 179.1325 61 I 4.2180 7.7271 122.0046 64.1990 36.9475 178.7166 62 T 3.9930 7.4430 116.6853 66.0276 68.1833 176.9296 63 A 3.9489 8.0225 122.8609 55.3318 18.5636 179.6662 64 L 4.1744 8.3342 119.0277 57.3485 41.7134 179.8779 65 L 4.0811 7.8622 118.9418 57.3147 41.5293 178.9740 66 E 3.9968 7.9018 119.4839 59.0412 29.7277 178.4333 67 E 3.9422 8.4844 118.7321 59.4928 29.3299 179.2647 68 A 4.1147 7.8358 119.5721 54.8672 18.6210 179.3767 69 Q 4.0085 7.8364 117.7448 59.5786 29.4386 178.0444 70 I 3.7001 8.2863 121.1208 64.6547 37.0386 178.2166 71 Q 3.9724 8.2198 120.2462 59.2372 28.7104 178.0583 72 Q 4.0685 7.9446 120.5182 59.3620 28.6920 179.5065 73 E 4.1883 8.0369 120.7903 61.5928 30.1215 183.3180 74 K 4.2364 7.5038 123.3574 59.7314 31.7829 178.2154 75 N 4.7189 8.1465 120.7027 53.3282 38.4258 174.8961 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 6 G 8.21 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.71 3.57 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 1.52 0.73 0.91 0.00 0.00 8 V 7.87 3.60 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 0.83 0.00 0.00 0.93 0.00 0.00 9 Q 7.98 4.04 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.52 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 10 Q 8.11 3.97 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.64 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 11 Q 8.21 3.93 0.00 2.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.59 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 12 Q 8.04 4.04 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 13 Q 7.87 3.96 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.67 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 14 L 8.15 4.01 0.00 1.81 1.72 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.80 4.10 0.00 1.82 1.89 0.92 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 16 D 7.76 4.55 0.00 2.98 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 3.57 2.22 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 1.08 0.00 0.00 1.01 0.00 0.00 18 V 7.74 3.60 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 0.94 0.00 0.00 0.98 0.00 0.00 19 K 7.54 4.02 0.00 2.24 1.89 0.00 1.57 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.51 7.81 20 R 8.26 4.84 0.00 1.98 1.95 0.00 3.35 0.00 0.00 3.54 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.67 0.00 21 Q 8.38 4.06 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 22 Q 7.77 3.96 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 23 E 7.78 4.01 0.00 2.20 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 2.31 2.51 0.00 24 L 7.89 4.01 0.00 1.93 1.87 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.09 4.09 0.00 1.99 1.72 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.13 3.98 0.00 2.07 2.02 0.00 3.11 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 27 L 7.60 4.17 0.00 1.86 1.74 0.88 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 T 7.95 4.16 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 29 V 8.22 4.05 2.23 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 1.04 0.00 0.00 1.06 0.00 0.00 30 W 8.02 4.20 0.00 3.57 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 0.00 31 G 8.63 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 4.02 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 33 K 7.71 4.01 0.00 1.77 1.60 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.25 7.81 *48 Q 8.66 4.50 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 49 E 8.12 4.08 0.00 2.10 2.01 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 2.45 2.36 0.00 50 W 8.60 4.27 0.00 3.43 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *51 E 7.92 4.27 0.00 2.06 1.82 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 2.26 2.18 0.00 52 R 7.70 4.55 0.00 1.91 2.15 0.00 3.14 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 53 K 7.58 3.97 0.00 1.88 1.79 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.65 7.81 54 V 7.44 3.41 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 -0.31 0.00 0.00 55 D 7.72 4.34 0.00 2.60 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 7.59 4.28 0.00 2.97 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.97 4.03 0.00 1.69 1.70 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.91 4.06 0.00 2.09 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 2.29 2.54 0.00 59 E 8.04 4.14 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 60 N 8.29 4.35 0.00 2.72 2.83 0.00 0.00 7.11 7.74 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 61 I 7.73 4.22 1.94 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 1.53 0.71 0.99 0.00 0.00 62 T 7.44 3.99 4.37 0.00 0.00 0.00 0.00 0.00 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 63 A 8.02 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.33 4.17 0.00 1.70 1.75 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.86 4.08 0.00 1.88 1.71 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.90 4.00 0.00 2.10 2.01 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 2.30 2.49 0.00 67 E 8.48 3.94 0.00 2.04 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 2.33 2.57 0.00 68 A 7.84 4.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 7.84 4.01 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 70 I 8.29 3.70 1.99 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 1.41 1.02 0.91 0.00 0.00 71 Q 8.22 3.97 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 72 Q 7.94 4.07 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.69 0.00 73 E 8.04 4.19 0.00 2.07 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.94 0.00 74 K 7.50 4.24 0.00 1.88 1.79 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.40 1.38 7.81 75 N 8.15 4.72 0.00 2.83 2.76 0.00 0.00 6.95 7.13 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 * Residues marked with a * may have inaccurate shift predictions.