NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 H 4.6173 8.3033 120.6498 56.1161 31.5965 172.8037 13 L 4.5134 8.0341 125.4687 51.8209 43.9339 170.5097 14 V 3.7009 7.4357 118.3524 59.7624 35.0875 173.8528 15 W 5.6174 7.8561 119.1265 55.2352 31.5299 174.0882 16 R 4.6197 9.0574 119.4758 55.1016 35.0597 173.7476 *18 G 4.0454 8.4142 106.2023 46.4642 0.0000 171.9276 19 R 4.9576 8.6519 119.8071 55.1213 31.6846 175.5400 20 A 4.4345 8.4081 126.3742 51.8020 18.6205 177.9219 21 E 4.0523 8.9476 120.6571 59.3265 29.8093 178.2783 22 D 4.6338 7.9908 116.4929 55.1426 41.6991 176.1296 23 E 4.7659 7.7444 116.3645 54.3939 33.4234 175.7409 24 D 4.7065 8.3883 121.8895 52.8291 39.9657 175.4786 25 V 4.6925 7.1274 120.6313 59.5710 35.8243 175.0531 26 L 4.6787 9.0138 126.6911 54.7608 43.1598 175.2712 27 V 4.6766 8.9798 127.2948 61.2849 33.3180 174.8856 28 V 4.5819 8.9633 128.4749 61.4414 33.6092 174.2483 29 R 5.3243 9.1238 127.9689 54.6865 32.7987 175.8329 30 V 5.4573 7.8308 121.1369 60.1849 35.6612 174.0668 31 G 2.4294 7.4555 107.4127 45.5625 0.0000 172.4385 32 L 4.5637 7.5072 118.8809 54.0401 42.5357 178.2906 33 A 3.8429 8.7912 123.9128 55.4839 17.9433 180.5061 34 S 4.1358 8.0005 110.7859 60.8577 63.3023 175.4912 35 A 4.3166 8.4591 123.6169 52.7951 18.6017 178.8075 36 T 3.6323 7.6925 115.6152 66.4855 68.6084 174.3590 37 P 4.3160 0.0000 0.0000 65.6525 30.8173 178.8386 38 R 4.0242 8.3784 117.0046 58.7971 29.8803 179.0749 39 F 3.9346 8.3382 118.0307 60.6051 38.7102 177.7484 40 R 4.0343 7.5484 115.8049 59.2347 29.9188 178.4605 41 E 4.1748 7.7327 115.7837 57.1502 29.7348 177.2021 42 L 4.3363 7.0283 118.9384 52.8579 42.6855 174.9039 43 P 4.2200 0.0000 0.0000 62.7624 31.6691 176.6266 44 R 3.9694 8.5165 123.1866 56.5454 30.4853 175.8018 45 L 4.6280 8.3003 125.0619 54.1319 43.1679 176.2756 46 L 4.4836 8.7833 122.4252 54.0719 43.1715 176.5083 47 N 4.9236 8.6682 119.7264 53.4474 39.4586 174.4450 48 L 4.8020 8.0834 119.2673 52.5234 46.1777 174.8063 49 P 4.5440 0.0000 0.0000 62.0145 32.2786 177.2976 50 E 3.8807 9.0032 120.7611 59.7724 29.8440 178.6212 51 A 4.1217 8.1934 120.8831 55.3891 18.5878 179.5154 52 E 4.1699 8.0631 115.6511 56.5290 29.2364 178.6424 *54 R 4.1796 8.1664 118.8848 55.8922 32.2328 177.1091 55 R 3.8788 8.0384 117.3328 59.5354 30.0448 178.4231 56 L 3.9764 8.0577 118.7094 57.7345 41.5475 179.6910 57 V 3.5733 7.7093 117.4782 66.3276 31.4250 178.0160 58 Q 4.0076 8.2204 116.3198 58.4151 28.5941 177.8427 59 E 4.3817 8.0138 117.4043 55.9256 29.8611 177.0915 60 G 3.8771 8.0570 107.4559 46.1585 0.0000 175.2853 61 R 4.5992 7.8573 120.9790 54.1622 28.0368 175.7992 62 V 5.1476 7.3779 118.3687 59.9730 35.4133 176.1179 63 R 4.6848 9.0767 118.9185 54.5171 32.6872 173.8922 64 V 4.9530 8.5648 122.8211 61.1874 33.2388 174.4494 65 E 4.8455 9.4853 125.9244 54.2506 32.6423 174.5858 66 W 4.9798 8.9245 132.7872 56.5652 32.0926 175.1119 67 V 3.9320 7.6726 126.8406 61.8212 32.7037 175.0494 68 E 3.8789 8.6372 126.6375 55.7456 27.8180 174.0798 69 E 4.3153 8.3413 121.4158 56.5634 29.8155 174.6302 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 H 8.30 4.62 0.00 3.20 3.14 0.00 5.62 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.03 4.51 0.00 0.38 0.72 1.14 0.73 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 14 V 7.44 3.70 1.60 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 0.26 0.00 0.00 0.25 0.00 0.00 15 W 7.86 5.62 0.00 3.26 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 16 R 9.06 4.62 0.00 1.93 1.95 0.00 3.34 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.85 0.00 *18 G 8.41 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.65 4.96 0.00 1.91 1.80 0.00 3.10 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 20 A 8.41 4.43 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 21 E 8.95 4.05 0.00 1.97 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 2.32 2.48 0.00 22 D 7.99 4.63 0.00 2.66 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 23 E 7.74 4.77 0.00 1.90 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 0.00 2.20 2.25 0.00 24 D 8.39 4.71 0.00 2.62 2.60 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 25 V 7.13 4.69 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 0.71 0.00 0.00 0.94 0.00 0.00 26 L 9.01 4.68 0.00 1.79 1.72 1.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.98 4.68 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 0.80 0.00 0.00 0.94 0.00 0.00 28 V 8.96 4.58 2.15 0.00 0.00 0.00 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 0.98 0.00 0.00 29 R 9.12 5.32 0.00 1.97 1.61 0.00 3.22 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 30 V 7.83 5.46 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 1.06 0.00 0.00 1.02 0.00 0.00 31 G 7.46 2.43 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 0.00 32 L 7.51 4.56 0.00 1.72 1.59 1.03 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.79 3.84 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.00 4.14 0.00 4.03 4.01 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 35 A 8.46 4.32 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 36 T 7.69 3.63 4.14 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 0.00 0.00 0.00 1.03 0.00 0.00 37 P 0.00 4.32 0.00 2.16 2.11 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 38 R 8.38 4.02 0.00 1.92 1.91 0.00 3.34 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 39 F 8.34 3.93 0.00 3.22 3.12 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 40 R 7.55 4.03 0.00 2.10 2.02 0.00 3.17 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 41 E 7.73 4.17 0.00 1.95 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 2.35 2.52 0.00 42 L 7.03 4.34 0.00 1.82 1.56 0.84 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.22 0.00 2.03 2.01 0.00 3.66 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 44 R 8.52 3.97 0.00 1.78 1.86 0.00 3.23 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 45 L 8.30 4.63 0.00 1.60 1.68 1.01 1.08 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 46 L 8.78 4.48 0.00 1.58 1.58 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.67 4.92 0.00 2.59 2.75 0.00 0.00 6.75 7.85 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 48 L 8.08 4.80 0.00 1.57 1.50 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.54 0.00 2.18 1.96 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 50 E 9.00 3.88 0.00 1.93 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 2.31 2.39 0.00 51 A 8.19 4.12 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 52 E 8.06 4.17 0.00 2.09 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 2.31 2.29 0.00 *54 R 8.17 4.18 0.00 1.90 2.15 0.00 3.24 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 55 R 8.04 3.88 0.00 2.08 2.23 0.00 3.15 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 56 L 8.06 3.98 0.00 1.73 1.88 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.71 3.57 2.20 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 1.16 0.00 0.00 0.93 0.00 0.00 58 Q 8.22 4.01 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.63 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 59 E 8.01 4.38 0.00 2.03 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 2.31 2.49 0.00 60 G 8.06 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.86 4.60 0.00 1.91 1.90 0.00 3.19 0.00 0.00 3.47 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 62 V 7.38 5.15 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 0.74 0.00 0.00 0.96 0.00 0.00 63 R 9.08 4.68 0.00 1.86 2.04 0.00 2.76 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 64 V 8.56 4.95 2.15 0.00 0.00 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 0.99 0.00 0.00 65 E 9.49 4.85 0.00 1.99 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 2.14 2.13 0.00 66 W 8.92 4.98 0.00 3.49 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 3.93 1.16 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 0.29 0.00 0.00 0.09 0.00 0.00 68 E 8.64 3.88 0.00 2.07 2.16 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 2.24 2.37 0.00 69 E 8.34 4.32 0.00 2.15 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 2.28 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.