NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 E 4.2096 8.2985 121.4701 56.1366 31.5176 177.0784 13 A 4.1171 8.0438 118.6614 51.7362 18.1315 176.3474 14 R 3.8311 7.3252 117.2962 59.6794 31.5644 174.4903 15 K 4.2796 7.6366 115.5524 57.6119 33.7631 175.8977 16 L 4.3263 9.0843 127.2942 56.2118 39.8906 175.6236 17 S 4.5670 8.2505 114.0398 60.2869 61.7745 174.4307 18 P 4.1891 0.0000 0.0000 65.6419 31.0130 178.5347 19 V 3.6818 7.7900 115.3015 66.6670 31.4999 177.3115 20 E 4.0677 8.1563 117.9840 59.2822 29.3337 179.0954 21 L 3.9838 8.8937 119.2224 57.9224 41.7760 179.1996 22 E 3.9284 9.3384 119.9838 59.2817 29.2338 179.0361 23 K 3.8924 8.0380 118.6183 59.4198 32.5762 177.9541 24 L 4.1064 8.0383 120.4498 58.3015 41.7561 179.3197 25 V 3.6411 8.2351 119.1471 64.7535 31.3486 178.4383 26 R 4.4954 7.8792 117.5105 55.6253 31.0943 176.7752 27 E 4.6685 9.0651 119.5971 56.5224 35.3209 176.9396 28 K 4.0362 8.1198 118.6909 59.5454 32.2564 178.1240 29 K 3.8945 8.0971 119.4928 58.6218 31.7557 178.6838 30 R 3.8324 7.8557 118.0216 59.6523 29.2327 177.8214 31 E 4.1310 7.9713 119.0032 57.6534 29.8562 178.1162 32 L 3.8968 8.1449 119.0507 54.3299 41.7193 180.5794 33 M 2.7193 9.7049 113.7814 56.3483 33.0963 178.0399 34 E 4.1061 9.1941 129.6248 56.8785 30.4900 175.0086 35 L 4.5470 7.9643 127.7766 55.4850 39.9289 177.2320 36 R 4.7211 8.7333 132.2381 55.6232 30.6651 176.3875 37 F 4.6409 7.9239 118.9434 56.8842 40.1501 173.2636 38 Q 3.9476 7.9196 123.7220 58.4942 29.3463 178.4164 39 A 4.2182 6.9945 125.3411 51.1198 16.9039 177.8083 40 S 5.0128 8.0575 117.3551 59.6499 63.1962 177.2859 41 I 3.7930 9.0066 120.3333 64.7605 37.7026 180.2942 42 G 3.6972 6.6066 106.5543 46.9034 0.0000 175.7950 43 Q 4.4150 8.2891 118.3976 56.4956 29.3390 178.1689 44 L 4.1685 8.6140 121.9543 57.7002 42.4883 179.9808 45 S 4.5382 7.6699 116.4951 58.0928 61.9920 176.6744 46 Q 3.8805 7.4861 123.3286 59.0689 29.5706 176.3135 47 N 5.0676 8.3149 114.4358 55.7229 37.0192 176.1553 48 H 4.6186 7.6500 113.3928 56.2786 31.2997 173.8693 49 K 4.3496 9.1901 126.0351 55.7342 40.2557 177.9146 50 I 3.8267 8.8352 119.6609 63.3757 38.1478 175.8453 51 R 3.7331 8.5231 121.8566 56.0634 27.8826 177.1606 52 D 4.7771 7.9376 122.6231 54.2511 43.4316 175.8579 53 L 4.0748 5.6322 117.5237 56.7996 43.2435 177.0602 54 K 4.0459 8.7990 122.3992 57.1798 29.4033 176.7498 55 R 4.4377 8.2155 113.6905 57.0588 32.4377 174.1121 56 Q 4.3847 7.9679 115.2195 54.5790 28.9498 174.5964 57 I 3.9787 8.1229 123.6384 59.2085 38.8132 175.1289 58 A 4.0177 8.4703 130.6649 52.3135 16.8198 176.5059 59 R 4.0380 8.1517 121.1912 56.6674 28.4725 176.2041 60 L 4.0303 8.0717 125.3234 55.6344 42.7262 176.1532 61 L 3.5199 8.4425 122.1154 56.7880 39.2263 175.6844 *62 T 4.1515 7.9622 115.8923 61.1280 69.1019 176.6949 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 8.04 4.12 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 7.33 3.83 0.00 1.80 2.03 0.00 3.10 0.00 0.00 3.22 7.55 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 4.28 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 9.08 4.33 0.00 1.81 2.17 0.92 0.75 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 17 S 8.25 4.57 0.00 3.97 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 18 P 0.00 4.19 0.00 2.20 2.07 0.00 3.69 0.00 0.00 3.87 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 7.79 3.68 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 0.87 0.00 0.00 0.93 0.00 0.00 20 E 8.16 4.07 0.00 2.34 1.94 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 2.33 2.50 0.00 21 L 8.89 3.98 0.00 1.69 1.74 0.98 1.06 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 22 E 9.34 3.93 0.00 2.21 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 0.00 2.31 2.38 0.00 23 K 8.04 3.89 0.00 1.77 2.01 0.00 1.88 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.44 7.81 24 L 8.04 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 8.24 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 0.90 0.00 0.00 0.91 0.00 0.00 26 R 7.88 4.50 0.00 1.92 1.97 0.00 3.18 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 9.07 4.67 0.00 2.10 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 0.00 2.22 2.25 0.00 28 K 8.12 4.04 0.00 1.99 1.72 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.56 1.74 7.81 29 K 8.10 3.89 0.00 1.78 1.69 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.42 7.81 30 R 7.86 3.83 0.00 1.95 2.08 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 1.67 1.65 0.00 31 E 7.97 4.13 0.00 2.25 2.23 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 2.92 2.68 0.00 32 L 8.14 3.90 0.00 1.27 1.27 0.99 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 33 M 9.70 2.72 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.00 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 9.19 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 7.96 4.55 0.00 1.81 1.79 0.94 0.59 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 8.73 4.72 0.00 2.11 2.02 0.00 3.29 0.00 0.00 3.19 7.30 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 7.92 4.64 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 7.92 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 7.19 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 39 A 6.99 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 8.06 5.01 0.00 4.17 4.13 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 41 I 9.01 3.79 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 6.61 3.70 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 0.00 0.00 0.00 43 Q 8.29 4.41 0.00 2.61 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 44 L 8.61 4.17 0.00 1.75 1.68 0.87 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 45 S 7.67 4.54 0.00 4.03 3.98 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 0.00 0.00 0.00 46 Q 7.49 3.88 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 47 N 8.31 5.07 0.00 2.95 3.10 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 7.65 4.62 0.00 3.06 3.51 0.00 5.81 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 9.19 4.35 0.00 1.72 1.17 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.24 1.44 7.81 50 I 8.84 3.83 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 0.90 0.91 0.00 0.00 51 R 8.52 3.73 0.00 1.98 2.15 0.00 3.53 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 52 D 7.94 4.78 0.00 2.84 2.75 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 0.00 0.00 0.00 53 L 5.63 4.07 0.00 1.78 1.67 0.91 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.80 4.05 0.00 1.94 1.88 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.40 7.81 55 R 8.22 4.44 0.00 1.76 1.92 0.00 3.24 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 56 Q 7.97 4.38 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 57 I 8.12 3.98 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 8.47 4.02 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 8.15 4.04 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 8.07 4.03 0.00 1.62 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.