NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 D 4.5309 8.3601 120.3135 52.7862 41.8701 175.6967 25 A 3.9251 7.6552 123.9504 51.6729 19.0062 176.6872 26 H 4.3056 9.4808 120.0227 59.1086 30.2834 175.3271 27 D 4.4972 8.3216 118.9002 57.6409 40.9135 179.2808 28 Q 4.2284 7.6057 115.9434 56.8023 28.5968 177.6671 *30 L 4.2810 7.9689 118.5424 54.2789 43.9250 178.8359 31 E 3.9194 8.4948 119.1620 59.0279 29.4031 178.6779 32 L 3.8498 7.9241 120.1180 58.1419 42.1606 178.5399 33 A 3.9445 8.0192 120.2422 55.3755 18.2232 179.1114 34 E 3.8718 8.2478 117.5579 59.2889 29.7481 178.9752 35 L 3.9662 7.9116 119.0900 57.6883 41.6829 179.3726 36 L 3.9406 8.1673 119.1903 58.2168 41.6140 179.5605 37 T 3.8525 8.1508 115.8676 66.8381 68.5357 176.1057 38 D 4.2991 8.0894 119.6607 57.5191 41.4193 178.7364 39 V 3.6853 7.8793 112.8584 64.0612 31.3705 178.7530 40 L 4.0959 7.9609 119.2184 57.8425 41.4159 179.5376 41 I 3.7964 7.5590 111.4541 63.8055 37.5512 177.9228 42 K 4.1959 7.8794 118.4179 58.0113 32.0043 177.1238 43 N 4.8372 7.6174 112.5407 52.2884 40.7211 174.4712 44 V 4.2051 7.9753 119.1296 59.8819 31.7114 172.6517 45 P 4.4629 0.0000 0.0000 63.7854 31.7150 177.3110 46 G 3.9389 8.8804 110.8259 45.1959 0.0000 173.2356 47 L 4.1373 7.4789 122.2976 54.2741 42.4344 177.3355 48 S 4.3038 8.5542 121.7419 58.1203 65.0260 174.5895 49 E 3.8804 8.7021 124.3216 59.3481 29.3599 179.0246 50 K 3.9984 7.9793 119.0164 60.1643 32.3119 178.2754 51 H 4.2613 8.1572 115.9150 58.7656 28.4291 177.6949 52 A 4.0714 7.9528 122.7317 54.7942 18.1990 179.3332 53 E 3.8949 8.5944 117.5870 59.7809 29.5949 179.1850 54 D 4.3856 8.4386 118.7774 57.4120 40.7146 178.8941 55 A 4.0288 7.7655 119.4858 55.4738 18.5373 179.5141 56 S 4.1660 8.0699 112.3832 61.7378 63.1717 176.8151 57 I 3.8921 8.1300 122.8268 64.4098 36.6320 177.8951 58 Y 4.0882 7.7260 115.0684 58.9650 38.8190 176.4937 *60 A 4.3423 7.8329 122.1364 52.0833 20.3797 179.6795 61 K 3.9980 8.2967 113.8786 58.9474 32.7289 177.1800 62 N 5.0652 7.3885 115.1764 52.1962 39.4128 176.5851 63 R 3.9332 8.2511 119.8969 59.6422 30.4605 176.7368 64 A 4.0056 7.9946 119.9109 55.2379 18.4069 179.5281 65 V 3.4560 7.7677 116.1944 66.2746 31.6387 178.1431 66 F 4.0229 8.3323 117.0781 60.2058 38.5105 177.4871 67 A 4.1466 8.4269 119.9785 55.1289 18.4156 179.2107 68 A 4.0706 8.2266 118.9517 55.3546 18.1288 179.4002 69 A 3.9498 8.2098 119.5751 55.5919 18.2140 179.3980 70 F 4.3007 8.1828 112.6930 58.8060 39.0861 176.5786 71 K 4.3951 8.8099 119.6770 56.0193 32.7839 176.8253 72 N 4.8230 7.0257 126.0604 55.3278 40.6453 175.6329 73 N 4.6621 7.1567 117.0086 52.3529 36.5160 175.5891 74 A 3.8922 7.9017 123.3667 54.8722 18.2150 178.6999 75 T 3.8120 8.3818 112.4490 64.3962 67.0453 175.6064 76 A 4.0900 8.0396 122.7285 55.1447 18.4288 179.5684 77 L 3.7938 7.8354 117.4900 57.9072 41.0987 179.8334 78 S 4.1472 7.5791 115.5757 61.5860 62.4339 176.5152 79 E 4.0681 7.9968 120.7038 58.8712 29.1820 177.7222 80 L 4.5349 7.3564 116.4123 53.8713 41.9045 176.6308 81 S 4.3499 7.7370 119.8473 59.2198 63.5467 176.2939 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 24 D 8.36 4.53 0.00 2.77 2.86 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 0.00 0.00 0.00 25 A 7.66 3.93 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 26 H 9.48 4.31 0.00 3.17 3.35 0.00 5.72 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 27 D 8.32 4.50 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.61 4.23 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.38 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 *30 L 7.97 4.28 0.00 1.91 1.74 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.49 3.92 0.00 2.12 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 0.00 2.29 2.31 0.00 32 L 7.92 3.85 0.00 1.80 1.68 0.88 1.23 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 33 A 8.02 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.25 3.87 0.00 2.14 2.10 0.00 0.00 0.00 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 2.34 0.00 35 L 7.91 3.97 0.00 1.83 1.67 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.17 3.94 0.00 1.90 1.69 0.85 0.60 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 37 T 8.15 3.85 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 1.21 0.00 0.00 38 D 8.09 4.30 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 3.69 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 0.95 0.00 0.00 0.98 0.00 0.00 40 L 7.96 4.10 0.00 1.71 1.71 0.92 0.72 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 41 I 7.56 3.80 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 1.80 0.52 0.95 0.00 0.00 42 K 7.88 4.20 0.00 1.87 1.91 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.47 1.57 7.81 43 N 7.62 4.84 0.00 2.85 2.81 0.00 0.00 6.71 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 44 V 7.98 4.21 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 1.01 0.00 0.00 0.95 0.00 0.00 45 P 0.00 4.46 0.00 2.08 1.97 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 46 G 8.88 3.94 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 0.00 0.00 0.00 47 L 7.48 4.14 0.00 1.64 1.76 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.55 4.30 0.00 4.03 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 49 E 8.70 3.88 0.00 2.04 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 0.00 2.51 2.37 0.00 50 K 7.98 4.00 0.00 1.81 1.68 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.52 7.81 51 H 8.16 4.26 0.00 3.24 3.32 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.95 4.07 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 53 E 8.59 3.89 0.00 2.26 2.03 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 2.33 2.44 0.00 54 D 8.44 4.39 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.77 4.03 1.39 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 0.00 0.00 0.00 56 S 8.07 4.17 0.00 3.83 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 57 I 8.13 3.89 2.13 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 1.41 0.70 0.94 0.00 0.00 58 Y 7.73 4.09 0.00 2.95 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 *60 A 7.83 4.34 1.35 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 0.00 0.00 61 K 8.30 4.00 0.00 1.88 1.83 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.43 7.81 62 N 7.39 5.07 0.00 2.94 2.86 0.00 0.00 6.48 7.54 0.00 0.00 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 R 8.25 3.93 0.00 2.08 1.95 0.00 3.19 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 64 A 7.99 4.01 1.33 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 0.00 0.00 0.00 65 V 7.77 3.46 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 0.82 0.00 0.00 0.87 0.00 0.00 66 F 8.33 4.02 0.00 3.45 3.36 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 67 A 8.43 4.15 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.23 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.21 3.95 1.09 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 70 F 8.18 4.30 0.00 3.23 3.13 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 0.00 0.00 0.00 0.00 71 K 8.81 4.40 0.00 2.03 1.87 0.00 1.96 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.46 7.81 72 N 7.03 4.82 0.00 2.80 2.81 0.00 0.00 7.22 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 73 N 7.16 4.66 0.00 2.83 2.73 0.00 0.00 6.82 7.10 0.00 0.00 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 A 7.90 3.89 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 75 T 8.38 3.81 4.21 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 1.15 0.00 0.00 76 A 8.04 4.09 1.24 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 0.00 0.00 0.00 77 L 7.84 3.79 0.00 1.77 1.62 0.74 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.58 4.15 0.00 4.11 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 79 E 8.00 4.07 0.00 2.15 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 2.32 2.53 0.00 80 L 7.36 4.53 0.00 1.84 1.88 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.74 4.35 0.00 3.80 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 * Residues marked with a * may have inaccurate shift predictions.