NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 E 4.2096 8.2985 121.4701 56.1737 31.5162 177.0997 13 A 4.0731 8.0486 118.6853 51.6837 17.9805 176.3333 14 R 3.7770 7.3170 116.5613 59.7486 31.3168 174.4122 15 K 4.1462 7.6421 115.1905 57.7062 33.6851 175.9114 16 L 4.2832 9.0935 127.3809 56.2216 39.8018 175.6268 17 S 4.5214 8.3934 114.1908 60.2919 61.8632 174.4078 18 P 4.2240 0.0000 0.0000 65.5522 30.9990 178.4337 19 V 3.6069 7.8659 115.3030 66.7455 31.3937 177.3475 20 E 4.0806 8.2094 118.1305 59.1034 29.3843 178.9415 21 L 3.9653 8.9166 119.6619 58.0317 41.7712 179.1451 22 E 3.9059 9.2555 119.9896 59.3874 29.2002 179.0752 23 K 3.8877 7.9188 118.1882 59.4383 32.5658 177.9632 24 L 4.1111 7.9515 120.4246 58.2502 41.7468 179.2913 25 V 3.6432 8.3240 119.0773 64.7832 31.3527 178.8744 26 R 4.4829 7.9748 117.9370 55.5096 30.8543 176.8817 27 E 4.6437 9.2290 119.6947 56.5637 35.0572 176.9205 28 K 3.9854 8.1849 118.7409 59.3103 32.3281 178.4162 29 K 3.9262 8.0152 119.2732 59.0495 31.8733 178.9066 30 R 3.8922 7.8408 116.5515 59.3974 29.2348 177.7331 31 E 4.1350 8.0524 119.3064 57.8621 29.8264 178.1420 32 L 3.8757 8.0291 118.7949 54.3933 41.7494 180.7835 33 M 2.6784 9.5905 113.8200 56.3430 33.3494 177.9347 34 E 4.1076 9.1120 128.9709 56.8048 30.5816 174.9792 35 L 4.5508 8.0022 127.7169 55.4276 39.9725 177.3278 36 R 4.7043 8.7179 132.6388 55.4356 30.6011 176.4367 37 F 4.6296 7.9091 119.0895 57.0039 40.1809 173.2617 38 Q 3.9455 7.9604 123.9578 58.5124 29.1811 178.4340 39 A 4.2152 7.0099 125.7144 51.1466 17.0040 177.8809 40 S 4.9974 8.1522 117.5434 59.6958 62.9475 177.2442 41 I 3.7303 9.0732 120.3605 64.8243 37.7201 180.1663 42 G 3.6877 6.6565 106.5594 46.9994 0.0000 175.7753 43 Q 4.4043 7.9719 119.1929 56.4565 29.7106 177.8082 44 L 4.2391 8.6534 122.4145 57.6690 42.5725 179.6951 45 S 4.7240 7.6347 115.8229 58.2055 62.5504 176.9182 46 Q 4.0510 8.2258 124.7795 59.2510 29.4242 176.4442 47 N 5.0352 8.3635 114.4667 55.7997 36.9796 176.0707 48 H 4.6024 7.6869 112.1182 56.4450 31.0101 173.8737 49 K 4.4356 8.9397 124.4961 55.9356 39.9505 178.4807 50 I 3.5814 8.8286 119.7495 63.0888 38.2674 175.6680 51 R 3.7889 8.4438 122.0731 55.8748 28.1517 177.2369 52 D 4.8731 8.0999 122.2234 54.3285 42.8552 176.1894 53 L 3.9251 5.6200 117.0670 56.7597 43.2661 176.7919 54 K 3.7638 8.8340 122.9233 57.2605 29.4013 176.6049 55 R 4.4629 8.3654 113.9915 56.7785 32.1953 174.1111 56 Q 4.3996 7.9880 115.0794 54.4985 29.0283 174.5692 57 I 4.0070 8.1267 123.6217 59.1693 38.8207 175.2920 58 A 4.0524 8.4571 130.7907 52.2556 16.6108 176.1472 59 R 4.0310 8.1354 120.8611 56.6304 28.5058 176.2052 60 L 4.0311 8.0606 125.2079 55.6302 42.7391 176.1665 61 L 3.5200 8.4433 122.1639 56.7932 39.2116 175.6838 *62 T 4.1515 7.9600 115.9281 61.1277 69.1019 176.7146 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 12 E 8.30 4.21 0.00 1.98 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 2.27 2.26 0.00 13 A 8.05 4.07 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 14 R 7.32 3.78 0.00 1.89 2.01 0.00 3.10 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 15 K 7.64 4.15 0.00 1.97 1.94 0.00 1.53 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.43 7.81 16 L 9.09 4.28 0.00 1.81 2.18 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.39 4.52 0.00 3.96 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 18 P 0.00 4.22 0.00 2.20 2.08 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 19 V 7.87 3.61 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 0.87 0.00 0.00 0.93 0.00 0.00 20 E 8.21 4.08 0.00 2.32 1.93 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 0.00 2.33 2.50 0.00 21 L 8.92 3.97 0.00 1.67 1.74 0.97 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 22 E 9.26 3.91 0.00 2.05 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 2.31 2.39 0.00 23 K 7.92 3.89 0.00 1.79 2.02 0.00 1.88 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 24 L 7.95 4.11 0.00 1.80 1.84 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.32 3.64 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 0.88 0.00 0.00 0.91 0.00 0.00 26 R 7.97 4.48 0.00 1.91 1.98 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 27 E 9.23 4.64 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 28 K 8.18 3.99 0.00 1.98 1.73 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.57 1.74 7.81 29 K 8.02 3.93 0.00 1.78 1.72 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.42 7.81 30 R 7.84 3.89 0.00 1.95 2.07 0.00 3.19 0.00 0.00 3.30 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 31 E 8.05 4.14 0.00 2.23 2.24 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 2.92 2.84 0.00 32 L 8.03 3.88 0.00 1.28 1.28 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 33 M 9.59 2.68 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 34 E 9.11 4.11 0.00 2.12 2.13 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 2.38 2.25 0.00 35 L 8.00 4.55 0.00 1.81 1.80 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.72 4.70 0.00 2.11 2.03 0.00 3.30 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 37 F 7.91 4.63 0.00 3.14 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.96 3.95 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 39 A 7.01 4.22 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 40 S 8.15 5.00 0.00 4.16 4.11 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 0.00 0.00 0.00 0.00 41 I 9.07 3.73 1.91 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 1.38 1.11 0.94 0.00 0.00 42 G 6.66 3.69 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 0.00 0.00 0.00 43 Q 7.97 4.40 0.00 2.55 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 44 L 8.65 4.24 0.00 1.80 1.64 0.87 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 45 S 7.63 4.72 0.00 3.93 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 46 Q 8.23 4.05 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 47 N 8.36 5.04 0.00 2.95 3.11 0.00 0.00 6.37 7.90 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 48 H 7.69 4.60 0.00 3.17 3.54 0.00 5.81 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.94 4.44 0.00 1.69 1.16 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.29 1.46 7.81 50 I 8.83 3.58 1.88 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 1.30 0.89 0.91 0.00 0.00 51 R 8.44 3.79 0.00 1.99 2.13 0.00 3.54 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 52 D 8.10 4.87 0.00 2.85 2.77 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 0.00 0.00 0.00 0.00 53 L 5.62 3.93 0.00 1.77 1.68 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.83 3.76 0.00 1.94 1.88 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.40 7.81 55 R 8.37 4.46 0.00 1.74 1.92 0.00 3.24 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 56 Q 7.99 4.40 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 57 I 8.13 4.01 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 1.35 0.84 0.91 0.00 0.00 58 A 8.46 4.05 1.27 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 0.00 0.00 59 R 8.14 4.03 0.00 1.76 1.90 0.00 3.30 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 60 L 8.06 4.03 0.00 1.74 1.56 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.44 3.52 0.00 1.83 1.73 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 *62 T 7.96 4.15 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.