NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 T 4.5098 8.0333 117.3394 62.8074 71.6990 173.3168 23 N 5.9559 7.9781 117.4807 50.2696 42.2081 172.1398 24 Y 4.9901 8.6063 118.2667 56.3188 43.0702 174.4162 25 V 4.6222 8.8505 121.7877 61.2954 35.6934 174.0269 *27 T 4.6314 8.1684 117.1431 63.6660 69.8156 174.2267 28 T 4.7379 8.4207 116.5949 60.0869 70.8878 175.8225 29 K 3.8007 8.8616 124.6715 59.7158 32.1557 177.3967 30 N 4.5641 8.0621 112.6206 53.1089 37.3332 175.4895 31 G 3.9230 8.3108 107.0523 45.5495 0.0000 173.7994 32 Q 4.4125 8.0519 118.7137 55.4430 30.6032 174.9665 33 T 4.9035 8.3678 117.8811 61.9319 70.8559 173.6705 34 I 4.5844 8.2225 126.5780 59.3971 40.4688 175.0911 35 V 4.4298 8.5260 127.0331 62.1934 32.8073 174.8676 36 T 4.9846 9.3018 116.9694 60.0794 72.5236 172.6339 37 Q 4.6613 8.9637 121.3620 55.5860 30.2814 177.1237 38 G 4.0201 9.6892 110.5732 44.9340 0.0000 172.2731 39 K 2.9516 8.0455 120.4199 54.6034 32.5677 175.0389 40 P 4.5595 0.0000 0.0000 63.0649 32.3481 175.4556 41 Q 4.6679 8.8461 121.1312 54.0742 31.5632 174.2258 42 L 4.9327 8.4780 124.8854 53.3837 44.5004 175.2518 43 D 4.7664 8.5204 126.0541 52.5660 41.1885 177.0123 44 K 4.2442 8.6502 122.7523 57.6149 31.9568 177.6119 45 E 4.6079 8.0131 117.4989 56.2529 30.9642 176.2809 46 T 4.4042 7.6363 106.2250 59.8832 70.8493 173.3838 47 G 3.6036 7.8040 111.7849 46.4725 0.0000 172.3542 *49 T 4.6807 7.3696 115.0097 63.7641 70.7608 174.1206 50 S 5.2640 8.7460 122.2265 57.4631 65.4419 172.8874 51 Y 5.1507 8.5535 119.4777 56.2477 42.4812 173.4585 52 T 4.8583 8.4463 115.6084 61.6024 71.4288 174.7449 53 D 4.9732 8.7250 127.3999 52.9089 40.5278 176.7678 54 Q 4.2624 8.6516 116.6673 57.9345 28.9022 176.7618 55 E 4.5225 9.1784 118.5431 55.7576 29.7674 178.4889 56 G 4.0555 7.9779 106.8005 45.9999 0.0000 174.8052 57 N 4.4989 8.0047 117.9029 53.5592 39.7944 173.8954 58 Q 4.8018 8.4528 120.9171 54.5090 30.9886 174.9456 59 R 4.6045 8.6039 122.1072 54.4839 34.6669 173.5310 60 E 5.2110 8.3142 118.6496 55.4609 32.5687 174.0378 61 I 4.7645 8.7816 124.8712 59.0415 41.8845 174.1850 62 N 4.5451 8.8418 126.1115 53.7953 38.9582 175.9898 63 S 4.1946 9.0405 122.6953 61.4843 63.1762 176.3605 64 N 4.5134 8.2764 116.3613 55.6271 38.7682 175.4882 65 D 4.5119 8.4192 117.1874 54.5635 41.1585 175.6498 66 V 4.3577 7.1855 119.1198 61.2023 32.0759 175.3698 67 A 4.1993 9.1841 131.6110 54.7712 18.6811 177.1454 68 Q 4.6245 7.5923 111.5832 54.2965 33.2652 174.7076 69 L 4.7868 8.5842 122.9955 53.5999 44.2940 175.0036 70 I 4.5583 8.7652 127.7188 58.7673 40.1621 175.2294 71 K 2.9469 8.3659 128.4290 55.7246 32.3981 176.3784 72 A 4.1604 8.4534 130.2505 52.0657 19.0600 176.4702 73 D 4.7711 8.3409 120.1281 52.5330 42.8416 176.9498 74 L 4.0790 8.4913 124.7384 57.7571 42.3086 176.2101 75 E 4.7303 7.5886 113.3465 55.0689 32.5595 173.5261 76 H 4.6436 8.5667 114.5517 55.2523 29.6918 174.1291 77 H 4.7895 8.0557 115.3600 55.6361 31.3568 173.0839 78 H 4.4656 8.9207 116.3237 56.2553 27.9366 175.1954 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 22 T 8.03 4.51 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 1.25 0.00 0.00 23 N 7.98 5.96 0.00 2.72 2.69 0.00 0.00 7.37 6.59 0.00 0.00 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 Y 8.61 4.99 0.00 2.86 2.80 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 25 V 8.85 4.62 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 1.04 0.00 0.00 0.92 0.00 0.00 *27 T 8.17 4.63 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 28 T 8.42 4.74 4.31 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 1.16 0.00 0.00 29 K 8.86 3.80 0.00 1.68 1.89 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.39 7.81 30 N 8.06 4.56 0.00 2.87 2.90 0.00 0.00 6.23 7.00 0.00 0.00 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 8.31 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 32 Q 8.05 4.41 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 33 T 8.37 4.90 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 34 I 8.22 4.58 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.58 0.85 0.00 0.00 35 V 8.53 4.43 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 0.89 0.00 0.00 0.94 0.00 0.00 36 T 9.30 4.98 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 1.16 0.00 0.00 37 Q 8.96 4.66 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.58 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 38 G 9.69 4.02 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 0.00 0.00 0.00 39 K 8.05 2.95 0.00 0.93 1.43 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.07 0.62 7.81 40 P 0.00 4.56 0.00 1.90 2.00 0.00 3.30 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.10 0.00 41 Q 8.85 4.67 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 42 L 8.48 4.93 0.00 1.60 1.52 0.92 1.19 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 43 D 8.52 4.77 0.00 2.73 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.65 4.24 0.00 1.74 1.85 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 45 E 8.01 4.61 0.00 1.90 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 2.21 2.31 0.00 46 T 7.64 4.40 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 47 G 7.80 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.37 4.68 4.28 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 1.26 0.00 0.00 50 S 8.75 5.26 0.00 3.95 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 51 Y 8.55 5.15 0.00 2.99 3.01 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 0.00 0.00 0.00 52 T 8.45 4.86 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 1.32 0.00 0.00 53 D 8.73 4.97 0.00 3.00 3.01 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 0.00 0.00 0.00 54 Q 8.65 4.26 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 7.50 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 55 E 9.18 4.52 0.00 2.10 1.92 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 2.25 2.24 0.00 56 G 7.98 4.06 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 0.00 0.00 0.00 57 N 8.00 4.50 0.00 3.14 2.69 0.00 0.00 6.75 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.45 4.80 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.75 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 59 R 8.60 4.60 0.00 0.67 1.52 0.00 3.19 0.00 0.00 2.95 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.30 0.00 60 E 8.31 5.21 0.00 1.88 1.75 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 2.21 2.32 0.00 61 I 8.78 4.76 2.04 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 1.14 0.99 1.05 0.00 0.00 62 N 8.84 4.55 0.00 2.85 3.01 0.00 0.00 7.05 7.63 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 63 S 9.04 4.19 0.00 3.89 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 64 N 8.28 4.51 0.00 2.70 2.88 0.00 0.00 6.95 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 65 D 8.42 4.51 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.19 4.36 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 0.73 0.00 0.00 0.90 0.00 0.00 67 A 9.18 4.20 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 68 Q 7.59 4.62 0.00 1.88 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 69 L 8.58 4.79 0.00 1.60 1.62 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 70 I 8.77 4.56 1.85 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 1.11 0.82 0.84 0.00 0.00 71 K 8.37 2.95 0.00 1.05 1.39 0.00 1.64 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.01 0.55 7.81 72 A 8.45 4.16 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.34 4.77 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 4.08 0.00 1.58 1.69 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 75 E 7.59 4.73 0.00 2.07 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 2.17 2.17 0.00 76 H 8.57 4.64 0.00 3.27 3.30 0.00 5.52 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.06 4.79 0.00 3.20 3.24 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 H 8.92 4.47 0.00 3.28 3.57 0.00 5.75 0.00 0.00 0.00 0.00 6.91 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.