NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4224 0.0000 0.0000 62.8823 32.8564 175.0915 3 E 4.6976 8.0678 118.9506 53.5107 33.0292 172.1732 4 T 5.1242 9.2107 116.0104 60.0825 72.5689 172.3288 5 L 4.8229 8.6744 121.5439 53.9330 47.0750 174.6486 6 C 4.6069 8.6560 119.3410 56.2430 41.5966 173.4307 7 G 3.8581 8.4959 107.8699 45.7034 0.0000 173.3693 8 A 3.9994 8.7835 118.9059 55.8172 18.1993 179.6985 9 E 3.7185 8.2411 116.1430 59.5945 29.4719 179.3694 10 L 3.8591 7.8006 119.7351 58.0358 42.1764 179.1916 11 V 3.4267 7.5139 117.9934 66.1393 31.5264 177.6855 12 D 4.4078 8.9346 119.1656 57.1930 40.5940 178.7612 13 A 3.9514 7.9435 121.1706 55.1554 18.4405 179.2064 14 L 3.6267 7.9416 117.8545 58.1166 41.5508 179.3742 15 Q 3.9682 8.1072 119.2764 59.6252 28.7387 178.6774 16 F 4.1980 8.0234 119.8031 61.2659 39.3997 176.9534 17 V 3.4991 7.7459 117.2430 65.9322 31.4426 177.0408 18 C 4.4184 8.2494 115.3911 57.6640 37.8430 175.1282 19 G 3.7953 8.5469 110.2421 44.2184 0.0000 173.4606 20 D 4.4814 8.5981 117.1719 54.8961 39.4189 177.2796 21 R 3.8003 8.0676 120.4802 59.2981 30.2072 176.4560 22 G 3.9361 8.7251 103.2262 44.8656 0.0000 172.0720 23 F 5.0290 7.4740 112.5195 55.0499 41.0018 173.3971 24 Y 4.6444 8.2516 118.7968 56.1173 40.6511 176.6824 25 F 4.6748 8.6790 121.4521 59.9184 39.5758 175.0011 26 N 5.8823 8.2880 116.1825 51.2715 42.2130 174.0816 27 K 4.6045 8.4509 119.2440 54.4895 35.9065 174.0007 28 P 4.3245 0.0000 0.0000 63.5902 32.1607 179.0785 29 T 3.4076 7.5318 112.5640 62.8689 66.1505 171.4843 *41 T 4.2418 7.5360 117.7067 62.1872 70.1238 174.2100 42 G 4.4200 8.2536 111.4382 43.6829 0.0000 173.3364 43 I 2.7926 8.3477 123.4314 63.4595 38.0911 176.7932 44 V 3.8950 7.7545 117.9203 63.3376 31.8935 175.7696 45 D 4.9342 8.8315 121.2298 55.5734 40.1478 176.0667 46 E 4.0132 7.6944 118.2245 59.7576 29.4630 178.6504 47 C 4.0562 8.4113 118.1296 59.1553 39.9709 175.6534 48 C 4.1869 7.7624 118.3852 58.4281 40.1497 174.4498 49 F 4.6680 7.4351 114.9410 57.0850 39.1290 175.4997 50 R 4.5282 7.2083 117.8726 55.8824 32.7138 174.2242 51 S 4.9036 8.8881 110.5245 57.3949 67.3350 172.7402 52 C 5.0998 8.9880 122.3980 55.0260 47.5404 172.5542 53 D 4.7623 8.4824 123.7203 50.9914 42.6916 176.0869 54 L 3.9926 8.7993 118.9614 57.8696 40.9741 180.0491 55 R 3.9584 8.0542 117.8332 60.2281 29.3528 179.5925 56 R 4.0980 7.8812 120.2329 60.7734 29.5628 180.3328 57 L 4.3229 8.1531 119.0493 57.8995 41.5363 179.2129 58 E 4.0929 8.1616 118.4622 59.0046 29.3590 178.2333 59 M 4.3294 7.8230 116.6184 57.1266 32.2186 176.3366 60 Y 4.6077 7.9838 116.3199 57.8008 38.7151 174.7347 61 C 5.1399 7.8566 117.5928 56.0046 41.5023 173.5163 62 A 4.3096 8.4863 123.8902 51.6944 18.5452 176.1245 63 P 4.4799 0.0000 0.0000 62.7603 31.1064 176.5367 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 P 0.00 4.42 0.00 2.19 2.13 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 3 E 8.07 4.70 0.00 2.09 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 2.25 2.35 0.00 4 T 9.21 5.12 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 1.20 0.00 0.00 5 L 8.67 4.82 0.00 1.48 1.45 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 6 C 8.66 4.61 0.00 2.72 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.50 3.86 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 0.00 0.00 0.00 8 A 8.78 4.00 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 9 E 8.24 3.72 0.00 2.15 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 2.37 2.35 0.00 10 L 7.80 3.86 0.00 1.81 1.80 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.51 3.43 2.29 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 1.20 0.00 0.00 1.21 0.00 0.00 12 D 8.93 4.41 0.00 2.79 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 3.95 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 14 L 7.94 3.63 0.00 1.10 0.41 0.51 0.58 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 15 Q 8.11 3.97 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 16 F 8.02 4.20 0.00 3.03 3.27 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 0.00 17 V 7.75 3.50 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 0.84 0.00 0.00 1.00 0.00 0.00 18 C 8.25 4.42 0.00 3.00 3.20 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 0.00 19 G 8.55 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 20 D 8.60 4.48 0.00 2.78 2.81 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 21 R 8.07 3.80 0.00 1.76 2.23 0.00 3.18 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 22 G 8.73 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 23 F 7.47 5.03 0.00 3.15 2.82 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 24 Y 8.25 4.64 0.00 3.07 2.90 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 25 F 8.68 4.67 0.00 3.31 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.29 5.88 0.00 2.66 2.76 0.00 0.00 6.67 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.45 4.60 0.00 1.53 1.49 0.00 0.68 0.00 0.00 0.82 0.00 0.00 2.59 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 1.23 7.81 28 P 0.00 4.32 0.00 1.90 1.98 0.00 3.54 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 29 T 7.53 3.41 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 1.21 0.00 0.00 *41 T 7.54 4.24 4.64 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 1.28 0.00 0.00 42 G 8.25 4.42 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 0.00 43 I 8.35 2.79 0.56 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.07 1.00 0.00 0.00 44 V 7.75 3.90 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.13 0.00 0.00 45 D 8.83 4.93 0.00 3.39 3.23 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 46 E 7.69 4.01 0.00 2.20 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 2.36 2.39 0.00 47 C 8.41 4.06 0.00 2.92 3.18 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 0.00 48 C 7.76 4.19 0.00 1.96 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.44 4.67 0.00 2.95 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 50 R 7.21 4.53 0.00 1.79 1.95 0.00 3.46 0.00 0.00 3.30 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 51 S 8.89 4.90 0.00 3.81 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 52 C 8.99 5.10 0.00 3.04 2.90 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 53 D 8.48 4.76 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.80 3.99 0.00 1.72 1.78 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.05 3.96 0.00 2.06 2.20 0.00 2.99 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.97 0.00 56 R 7.88 4.10 0.00 1.97 1.90 0.00 3.27 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 57 L 8.15 4.32 0.00 1.88 1.72 0.90 0.51 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 58 E 8.16 4.09 0.00 2.09 2.12 0.00 0.00 0.00 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 2.48 0.00 59 M 7.82 4.33 0.00 2.02 2.45 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 2.90 2.60 0.00 60 Y 7.98 4.61 0.00 3.25 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 61 C 7.86 5.14 0.00 2.83 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 62 A 8.49 4.31 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 1.98 2.00 0.00 3.87 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 * Residues marked with a * may have inaccurate shift predictions.