NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 A 4.3434 8.1233 123.5820 52.0765 20.6596 177.2559 102 E 4.1035 7.9712 114.3212 56.1796 30.1681 173.9636 *104 E 4.3580 8.5013 121.4523 56.4524 32.3935 178.2935 105 Q 3.9027 7.5615 118.5538 56.2147 28.5883 178.1393 *107 K 4.2377 8.2745 116.4400 56.0292 34.3263 178.2140 108 K 3.9087 7.9930 118.0397 59.9160 31.8268 179.2713 109 E 4.0862 8.1755 118.2992 59.2995 29.0770 179.4959 110 I 3.8434 7.6032 118.6912 64.0803 37.4346 177.7351 111 A 4.1530 8.2825 121.3842 55.0278 18.4424 178.7845 112 Y 4.1973 8.1533 118.0983 60.6796 38.6976 179.6856 113 L 4.1057 7.3659 117.8590 55.2516 42.2368 177.6192 *115 K 4.2328 8.1046 121.3182 56.6018 33.5613 178.9010 116 K 3.9062 7.5862 115.7548 55.1145 30.8456 178.9844 *118 K 4.1333 8.0673 118.9285 57.2714 33.3448 176.8900 *120 E 4.3172 8.0920 117.5694 56.2403 31.3517 177.2047 121 I 4.0138 7.7292 118.2928 63.9394 37.5171 178.0471 122 L 4.2122 7.6259 119.7213 54.9157 40.5325 177.2612 *124 E 4.1162 8.1605 115.4184 56.3266 31.0460 178.2765 *126 K 4.2348 8.0042 120.2144 56.6384 34.0818 178.7835 127 K 4.2360 7.6312 115.6434 56.9593 31.1921 178.8560 *129 K 4.2413 8.2171 123.3506 57.0769 33.9586 178.8663 130 Q 4.0532 7.8411 119.1644 58.0702 28.3499 182.2709 131 E 4.2334 7.8706 113.3478 58.9127 30.1189 181.6001 132 I 3.8568 7.8428 118.1627 64.4309 37.4774 175.7800 133 A 4.1605 7.5155 126.2476 52.3999 18.1048 176.9903 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 101 A 8.12 4.34 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 0.00 102 E 7.97 4.10 0.00 2.05 1.97 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 2.28 2.36 0.00 *104 E 8.50 4.36 0.00 2.07 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 2.27 2.37 0.00 105 Q 7.56 3.90 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.43 6.13 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 *107 K 8.27 4.24 0.00 2.09 1.89 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.48 7.81 108 K 7.99 3.91 0.00 1.99 1.87 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.67 7.81 109 E 8.18 4.09 0.00 2.06 2.02 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 2.30 2.59 0.00 110 I 7.60 3.84 2.01 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 1.59 0.49 0.93 0.00 0.00 111 A 8.28 4.15 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 0.00 112 Y 8.15 4.20 0.00 3.17 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 0.00 113 L 7.37 4.11 0.00 1.84 1.68 0.95 0.67 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 *115 K 8.10 4.23 0.00 1.84 1.90 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.39 7.81 116 K 7.59 3.91 0.00 1.82 1.67 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.25 7.81 *118 K 8.07 4.13 0.00 1.77 1.95 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.45 7.81 *120 E 8.09 4.32 0.00 1.99 2.02 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 2.18 2.47 0.00 121 I 7.73 4.01 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.46 0.90 0.00 0.00 122 L 7.63 4.21 0.00 1.64 1.68 0.91 0.72 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 *124 E 8.16 4.12 0.00 2.18 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 2.50 2.28 0.00 *126 K 8.00 4.23 0.00 1.84 1.89 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.75 7.81 127 K 7.63 4.24 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.41 7.81 *129 K 8.22 4.24 0.00 2.00 1.89 0.00 1.65 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.44 7.81 130 Q 7.84 4.05 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.17 0.00 131 E 7.87 4.23 0.00 1.93 1.90 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 2.26 2.15 0.00 132 I 7.84 3.86 2.03 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 1.34 0.94 0.91 0.00 0.00 133 A 7.52 4.16 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 * Residues marked with a * may have inaccurate shift predictions.