NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 V 3.9698 8.0549 114.0536 60.5446 33.9182 175.1752 11 L 4.3064 7.6173 120.4888 51.2912 41.2836 173.6087 12 T 5.1171 8.8349 113.7503 59.7965 73.0814 173.8083 13 V 4.0963 8.5188 113.5428 62.8492 34.1775 177.5668 *25 K 4.3374 7.9880 117.6122 55.7526 33.9374 174.3797 26 P 4.5159 0.0000 0.0000 63.0278 31.9262 176.5799 27 L 3.9041 9.2356 125.2328 58.5202 41.8994 179.4447 28 R 3.8961 8.1124 115.2092 59.6987 28.9573 178.3605 29 D 4.3630 8.2016 119.4563 57.2300 40.7394 178.8249 30 S 4.1448 8.1890 116.0258 61.2387 62.7805 176.8478 31 V 3.5137 7.5604 120.5764 65.8373 31.3329 177.9238 32 K 3.8478 8.0499 118.2228 59.6226 31.8489 179.0594 33 Q 3.8753 8.0484 119.4017 59.0993 28.9219 178.0591 34 A 3.9376 8.0713 121.8124 55.2562 18.3318 179.6749 35 L 3.6488 7.9505 117.4660 57.3099 41.4222 179.6855 36 K 3.7826 7.9390 119.8670 59.5587 31.9714 178.6261 37 N 4.3440 8.1146 115.7035 56.3768 38.6731 176.5161 38 Y 4.4075 8.1488 120.9030 60.9905 38.7640 178.1359 39 F 4.2932 8.3176 118.5114 60.4558 38.7488 177.1548 40 A 4.1582 7.7356 118.9637 54.0344 18.2776 178.6440 41 Q 4.2570 8.0204 115.7365 57.6595 29.5736 176.2773 42 L 4.0381 7.1639 119.0605 53.9801 42.8284 176.1248 *47 V 3.9824 7.9521 117.7721 63.7401 32.0740 175.2727 48 N 5.1772 8.6084 120.9106 52.7519 38.1634 174.0254 49 D 4.9357 8.0780 116.0077 52.8708 40.6018 176.9173 50 L 4.0217 8.4185 124.0776 59.2763 41.8441 177.8771 51 Y 4.0456 8.0296 118.8568 60.8894 38.8688 177.6556 52 E 3.8922 8.2929 119.0723 59.0140 29.3737 178.7777 53 L 3.8889 7.9992 120.0920 58.2854 42.3690 179.0614 54 V 3.5856 7.7321 117.9475 65.7659 31.4033 177.4966 55 L 3.7244 7.7878 120.0261 58.2632 41.6197 178.9350 56 A 3.7369 8.2969 120.8934 54.9004 18.1364 178.7499 57 E 3.9434 7.6760 115.5697 57.7073 30.0956 177.7495 58 V 4.0873 7.1531 116.7490 64.7463 33.1394 177.0570 59 E 3.8677 8.6025 118.7755 58.9976 29.1800 178.8062 60 Q 3.5943 7.1251 119.8295 58.7174 29.0294 176.9760 61 P 4.1619 0.0000 0.0000 65.4954 31.2868 177.9791 62 L 3.8583 7.6437 119.6494 57.9951 41.9869 178.9376 63 L 3.9640 8.1440 119.1887 57.8594 41.5780 179.1486 64 D 4.3611 8.1833 118.7981 57.8697 40.8184 179.0076 65 M 4.1249 8.3957 119.6389 58.2107 31.9537 179.3168 66 V 3.6621 8.0078 119.5005 65.1698 31.6931 178.4007 67 M 4.0984 8.2635 119.7692 57.8634 31.7768 178.4398 68 Q 3.9396 8.2376 119.7176 59.5268 29.0532 177.7969 69 Y 4.1393 8.3929 119.7360 60.2686 38.9622 177.2028 70 T 4.2749 8.0135 108.3629 60.4542 69.3535 174.7606 71 R 3.7230 8.5515 119.3376 57.8319 27.8349 177.3563 72 G 3.8000 8.7564 104.6965 45.9884 0.0000 174.5060 73 N 4.5527 7.7896 119.2089 52.6983 39.2044 175.3177 74 Q 4.0308 8.5759 128.3890 59.2095 28.9084 178.7182 75 T 3.8451 7.9248 116.1832 66.9130 68.5964 176.6739 76 R 3.9310 8.5882 119.7506 59.0946 30.0493 179.0954 77 A 3.9837 8.2032 120.3593 55.0460 18.4422 179.4593 78 A 3.9554 8.4599 119.6606 55.4416 17.9693 179.8204 79 L 3.9720 8.1160 117.5275 58.3230 41.4531 179.7879 80 M 4.1244 7.8714 117.6548 58.5626 31.9940 178.3212 81 M 4.2850 8.1060 117.3718 55.8866 32.2552 177.0988 82 G 3.8953 7.7438 106.2014 45.9610 0.0000 173.1506 83 I 4.6601 7.5077 111.3184 57.6000 40.7272 175.2458 84 N 4.6427 8.3612 119.5064 52.5000 39.3705 176.0333 85 R 4.0040 8.5342 120.3911 59.4134 30.0979 178.5836 86 G 3.6346 8.0552 105.1326 48.2411 0.0000 175.6791 87 T 3.9397 8.7119 118.7683 65.9377 68.3581 176.5798 88 L 3.9588 7.8862 122.3082 58.4847 42.1117 179.4179 89 R 3.9267 8.2194 117.9827 58.9819 29.9190 179.0423 90 K 3.9279 8.0305 119.6572 59.3668 32.1980 179.1540 91 K 3.9874 8.2895 118.8883 59.4322 31.9995 179.2905 92 L 4.0927 8.1948 119.4794 57.6630 41.4317 179.6302 93 K 3.8829 8.2823 119.5970 59.3017 31.9851 178.4961 94 K 3.6702 8.0273 118.9795 59.8213 32.0366 177.3580 95 Y 4.5733 7.6066 113.2407 57.2085 37.8535 175.5757 96 G 3.9470 8.0706 107.9199 47.1922 0.0000 174.7440 97 M 4.4200 8.6068 118.3160 54.6471 32.7836 176.3376 98 N 4.5298 8.0167 121.6181 53.0747 37.5064 174.7890 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 10 V 8.05 3.97 2.06 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 0.88 0.00 0.00 0.91 0.00 0.00 11 L 7.62 4.31 0.00 1.74 1.58 0.89 0.27 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 12 T 8.83 5.12 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 1.20 0.00 0.00 13 V 8.52 4.10 2.06 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 0.71 0.00 0.00 0.94 0.00 0.00 *25 K 7.99 4.34 0.00 1.83 1.88 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.52 1.49 7.81 26 P 0.00 4.52 0.00 2.16 2.00 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 27 L 9.24 3.90 0.00 1.73 1.71 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.11 3.90 0.00 2.06 2.19 0.00 3.01 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 29 D 8.20 4.36 0.00 2.90 2.74 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 30 S 8.19 4.14 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 31 V 7.56 3.51 2.21 0.00 0.00 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 0.89 0.00 0.00 32 K 8.05 3.85 0.00 1.99 1.82 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.59 7.81 33 Q 8.05 3.88 0.00 2.24 2.06 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 2.34 2.40 0.00 34 A 8.07 3.94 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 35 L 7.95 3.65 0.00 1.59 1.00 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.94 3.78 0.00 1.84 1.94 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 37 N 8.11 4.34 0.00 2.88 2.89 0.00 0.00 7.05 7.94 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 38 Y 8.15 4.41 0.00 3.03 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 39 F 8.32 4.29 0.00 3.04 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 40 A 7.74 4.16 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.02 4.26 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.80 0.00 0.00 0.00 0.00 0.00 2.62 2.65 0.00 42 L 7.16 4.04 0.00 1.48 1.53 0.66 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 *47 V 7.95 3.98 2.14 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 1.01 0.00 0.00 0.99 0.00 0.00 48 N 8.61 5.18 0.00 2.82 2.81 0.00 0.00 5.85 8.06 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 49 D 8.08 4.94 0.00 2.83 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.42 4.02 0.00 1.96 1.87 1.19 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.03 4.05 0.00 3.17 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 52 E 8.29 3.89 0.00 2.07 2.02 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 2.56 2.39 0.00 53 L 8.00 3.89 0.00 1.66 1.89 0.84 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.73 3.59 1.94 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 0.84 0.00 0.00 0.94 0.00 0.00 55 L 7.79 3.72 0.00 1.66 1.65 0.62 1.02 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 56 A 8.30 3.74 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.68 3.94 0.00 1.82 2.02 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 2.21 2.25 0.00 58 V 7.15 4.09 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 0.98 0.00 0.00 0.88 0.00 0.00 59 E 8.60 3.87 0.00 1.80 1.81 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 2.30 2.33 0.00 60 Q 7.13 3.59 0.00 1.61 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 61 P 0.00 4.16 0.00 2.23 2.22 0.00 3.54 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 62 L 7.64 3.86 0.00 1.79 1.82 0.88 0.71 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 63 L 8.14 3.96 0.00 1.83 1.71 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.18 4.36 0.00 2.86 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 65 M 8.40 4.12 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.81 0.00 66 V 8.01 3.66 2.06 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 0.93 0.00 0.00 0.99 0.00 0.00 67 M 8.26 4.10 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.83 0.00 68 Q 8.24 3.94 0.00 2.21 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 69 Y 8.39 4.14 0.00 3.00 3.16 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 0.00 70 T 8.01 4.27 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 71 R 8.55 3.72 0.00 1.95 2.05 0.00 3.22 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 72 G 8.76 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 N 7.79 4.55 0.00 2.72 2.75 0.00 0.00 7.18 6.93 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 74 Q 8.58 4.03 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.67 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 75 T 7.92 3.85 4.39 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 0.00 0.00 0.00 1.22 0.00 0.00 76 R 8.59 3.93 0.00 2.00 2.03 0.00 3.18 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 77 A 8.20 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.46 3.96 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.12 3.97 0.00 1.86 1.75 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 80 M 7.87 4.12 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.61 0.00 81 M 8.11 4.28 0.00 2.00 2.19 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 82 G 7.74 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.51 4.66 1.89 0.00 0.00 0.88 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 0.79 0.93 0.00 0.00 84 N 8.36 4.64 0.00 3.02 3.01 0.00 0.00 5.63 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.53 4.00 0.00 1.91 1.97 0.00 3.19 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 86 G 8.06 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.71 3.94 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 1.23 0.00 0.00 88 L 7.89 3.96 0.00 1.80 1.88 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 89 R 8.22 3.93 0.00 2.02 1.97 0.00 3.19 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 90 K 8.03 3.93 0.00 1.95 1.97 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 91 K 8.29 3.99 0.00 2.07 2.01 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.67 7.81 92 L 8.19 4.09 0.00 1.88 1.76 0.94 0.93 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 93 K 8.28 3.88 0.00 1.97 1.95 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.46 7.81 94 K 8.03 3.67 0.00 1.56 1.60 0.00 1.59 0.00 0.00 1.13 0.00 0.00 2.64 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.43 1.14 7.81 95 Y 7.61 4.57 0.00 3.06 2.96 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 96 G 8.07 3.95 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 0.00 0.00 0.00 97 M 8.61 4.42 0.00 2.00 2.27 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 2.85 2.49 0.00 98 N 8.02 4.53 0.00 2.84 2.82 0.00 0.00 5.96 7.56 0.00 0.00 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.