NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9170 8.3393 109.7368 45.2407 0.0000 174.2247 3 K 4.1608 7.7290 118.6277 54.3866 34.2881 170.4582 4 V 4.5483 8.4025 120.2224 61.5218 36.0553 174.7332 5 Y 5.0062 8.7615 123.0748 55.9818 41.4232 174.6340 6 K 4.4810 8.2255 122.4374 54.4755 35.1250 174.7970 7 K 5.0695 8.5719 125.4990 54.6252 34.6642 175.6084 8 V 4.5045 8.8618 123.8608 61.0365 35.0300 173.6854 9 E 4.9721 8.8516 128.1826 55.1101 30.4676 174.8908 10 L 4.9252 9.1707 126.9505 52.8167 45.9690 175.7604 11 V 4.7650 8.3517 120.7499 61.2059 33.6205 174.9684 12 G 4.6343 9.0706 116.1938 44.8892 0.0000 172.2562 13 T 5.3240 8.0550 113.1707 60.1133 72.0716 173.0502 14 S 4.6477 8.6932 114.6411 58.0244 66.0258 175.8377 15 E 4.5288 9.0039 124.0000 57.1238 30.0393 177.9811 16 E 4.1329 8.2240 118.5927 57.4144 30.0738 176.8375 17 G 3.3109 7.0544 103.8454 44.3184 0.0000 173.2924 18 L 3.7177 7.4405 118.1666 57.9208 41.5351 179.2661 19 E 3.8970 8.0057 117.7709 59.3503 29.3752 179.1304 20 A 3.9160 7.8952 120.0733 54.9569 18.4728 179.3684 21 A 3.9112 7.7739 118.8681 55.3145 18.5006 179.9015 22 I 3.4638 7.6088 118.2410 64.7237 37.1878 178.7315 23 Q 3.9071 8.2755 118.8383 58.6848 28.5771 178.7725 24 A 3.9156 8.1430 121.6941 55.1450 18.4608 179.5361 25 A 3.9043 7.8242 118.6722 55.4038 18.5523 179.7608 26 L 3.8960 7.9254 117.2563 57.5652 41.3996 179.5790 27 A 3.9497 8.1689 120.6672 55.0214 18.6369 179.3839 28 R 3.9041 7.8637 116.5839 59.5412 30.1375 178.4465 29 A 3.9062 8.0025 120.5871 55.2961 18.1030 179.5677 30 R 3.7797 7.8624 115.8322 59.0953 30.1374 178.5408 31 K 4.1718 7.8649 117.8869 58.5190 32.1315 177.6082 32 T 4.5347 7.7020 105.3900 60.3568 70.3694 173.5246 33 L 4.5242 7.8706 122.0952 52.8038 43.9348 175.9278 34 R 4.5037 8.0519 120.4922 55.5457 32.8483 174.9049 35 H 4.1899 8.4837 113.0742 56.8949 26.0893 175.1117 36 L 4.5851 8.1398 118.9981 55.2917 42.1824 175.8206 37 D 5.1546 9.1736 122.5749 55.4555 43.2247 176.2353 38 F 5.2507 7.6071 111.3019 55.4489 41.6004 172.7811 39 F 5.5711 8.4266 113.4679 55.5496 41.5917 173.8168 40 E 4.6586 9.3003 118.5925 54.8386 33.6610 174.8907 41 V 4.2328 8.7304 125.5005 63.0840 31.6775 175.4898 42 K 4.5328 9.2925 128.3369 58.3800 33.2558 176.6395 43 E 4.8013 7.8401 115.0196 55.4164 32.9118 174.1192 44 I 4.9439 8.3527 121.1637 59.9264 39.8255 175.0213 45 R 4.7160 9.4651 125.7162 54.9670 34.9439 173.7668 46 G 4.0916 7.7269 105.7221 47.2031 0.0000 172.0869 47 T 4.8196 7.8797 109.4577 59.8546 72.0359 173.2794 48 I 4.7784 8.2471 122.4128 59.8429 39.8832 175.5685 49 G 4.0892 8.8204 114.8824 44.1886 0.0000 171.8250 50 E 3.8151 8.9048 119.1988 58.9973 29.6933 179.7258 51 A 4.8070 7.9433 119.0021 51.5256 20.8591 176.7343 52 G 3.9612 7.5856 117.6254 45.3054 0.0000 177.3822 53 V 3.7972 8.3495 123.8072 62.6374 31.8631 174.4782 54 K 4.1842 8.7242 129.7094 58.1999 33.0989 175.3664 55 E 4.6025 7.9046 119.8604 54.3699 33.0085 173.6074 56 Y 4.6815 9.0530 125.2661 57.7648 39.8078 174.6032 57 Q 4.9361 9.4684 122.7763 54.3171 32.4626 174.4845 58 V 4.6593 8.7127 125.8186 61.1671 33.5661 174.7393 59 V 4.5480 8.7814 129.5363 62.1408 32.9483 174.4886 60 L 5.2609 9.1671 129.6960 53.4757 45.7853 174.5808 61 E 5.0435 9.4320 126.0890 55.1825 31.6337 175.1312 62 V 4.6668 9.0109 124.5504 61.0409 34.3655 174.1898 63 G 3.8402 8.4692 115.9964 44.1704 0.0000 172.2147 64 F 5.6003 8.6951 118.6418 54.8114 41.8727 173.7747 65 R 4.0087 8.8513 122.0637 56.0677 30.5351 176.0668 66 L 4.3143 8.1531 127.0437 54.4844 42.3994 176.8303 67 E 3.9962 8.8598 123.2729 56.9640 30.2958 174.7448 68 E 3.3912 8.6440 129.9246 56.6384 30.2097 174.9192 *69 T 4.1630 8.2748 112.7285 61.1064 69.2274 174.8564 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 8.34 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.73 4.16 0.00 1.70 1.71 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.54 7.81 4 V 8.40 4.55 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 0.98 0.00 0.00 0.90 0.00 0.00 5 Y 8.76 5.01 0.00 2.84 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 6 K 8.23 4.48 0.00 1.46 0.74 0.00 1.42 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.27 7.81 7 K 8.57 5.07 0.00 1.67 1.87 0.00 1.95 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.42 7.81 8 V 8.86 4.50 2.26 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 1.06 0.00 0.00 1.11 0.00 0.00 9 E 8.85 4.97 0.00 2.04 1.87 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 2.25 2.36 0.00 10 L 9.17 4.93 0.00 1.54 1.48 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.35 4.76 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 0.85 0.00 0.00 0.94 0.00 0.00 12 G 9.07 4.63 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 13 T 8.06 5.32 4.38 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 1.26 0.00 0.00 14 S 8.69 4.65 0.00 3.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 9.00 4.53 0.00 2.03 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 2.46 2.30 0.00 16 E 8.22 4.13 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 17 G 7.05 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.44 3.72 0.00 1.53 1.62 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.01 3.90 0.00 1.98 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 2.38 2.42 0.00 20 A 7.90 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 21 A 7.77 3.91 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.61 3.46 1.86 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 1.38 0.76 0.36 0.00 0.00 23 Q 8.28 3.91 0.00 2.12 2.10 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 2.45 2.48 0.00 24 A 8.14 3.92 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.82 3.90 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 3.90 0.00 1.61 1.65 0.59 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.17 3.95 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 28 R 7.86 3.90 0.00 1.94 2.04 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 29 A 8.00 3.91 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.86 3.78 0.00 1.95 2.12 0.00 3.25 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 31 K 7.86 4.17 0.00 1.90 1.82 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.61 7.81 32 T 7.70 4.53 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 1.17 0.00 0.00 33 L 7.87 4.52 0.00 1.38 0.94 0.39 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.05 4.50 0.00 1.68 1.53 0.00 3.27 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.53 0.00 35 H 8.48 4.19 0.00 3.64 3.47 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.14 4.59 0.00 1.66 1.66 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.17 5.15 0.00 2.91 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 38 F 7.61 5.25 0.00 2.94 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 39 F 8.43 5.57 0.00 3.06 2.98 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 0.00 0.00 0.00 40 E 9.30 4.66 0.00 1.99 1.90 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 2.33 2.48 0.00 41 V 8.73 4.23 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 0.88 0.00 0.00 1.13 0.00 0.00 42 K 9.29 4.53 0.00 1.66 1.87 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.56 7.81 43 E 7.84 4.80 0.00 2.02 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 2.30 2.35 0.00 44 I 8.35 4.94 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.72 1.01 0.00 0.00 45 R 9.47 4.72 0.00 1.67 1.81 0.00 3.55 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 46 G 7.73 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.88 4.82 4.20 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 1.19 0.00 0.00 48 I 8.25 4.78 1.84 0.00 0.00 0.83 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 0.63 0.95 0.00 0.00 49 G 8.82 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.90 3.82 0.00 1.92 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 2.30 2.35 0.00 51 A 7.94 4.81 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 52 G 7.59 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 53 V 8.35 3.80 1.80 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 -0.24 0.00 0.00 0.70 0.00 0.00 54 K 8.72 4.18 0.00 1.92 1.69 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.35 7.81 55 E 7.90 4.60 0.00 1.95 1.68 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 2.20 2.27 0.00 56 Y 9.05 4.68 0.00 3.14 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.47 4.94 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 58 V 8.71 4.66 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.95 0.00 0.00 59 V 8.78 4.55 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.95 0.00 0.00 60 L 9.17 5.26 0.00 1.71 1.53 0.97 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 61 E 9.43 5.04 0.00 2.00 1.89 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 2.32 2.30 0.00 62 V 9.01 4.67 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.94 0.00 0.00 63 G 8.47 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.70 5.60 0.00 3.32 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.85 4.01 0.00 1.94 1.86 0.00 3.06 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.80 0.00 66 L 8.15 4.31 0.00 1.55 1.53 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.86 4.00 0.00 2.00 1.90 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 2.38 2.43 0.00 68 E 8.64 3.39 0.00 2.05 1.88 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 2.19 2.22 0.00 *69 T 8.27 4.16 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 * Residues marked with a * may have inaccurate shift predictions.