NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.3255 8.0433 122.7538 54.9042 43.9197 175.0206 10 L 4.9405 8.4713 125.3608 53.0217 43.3510 174.2624 11 L 5.0115 8.9676 123.2219 52.8060 46.4207 174.8038 12 E 5.0226 8.3732 116.7517 55.2524 33.0530 173.9346 13 C 4.8654 8.9713 121.9447 58.9005 30.0841 172.1564 14 T 4.8026 8.3819 118.6413 59.2368 69.2580 176.1730 15 E 3.8413 8.8442 132.8841 61.4552 28.4991 178.7191 16 C 3.9619 6.6781 109.7793 59.8464 27.3006 171.2703 17 K 4.4457 7.7117 133.2132 56.4483 30.1398 176.1736 18 R 4.6442 6.9782 121.3808 56.0500 27.9832 175.8044 19 R 4.0474 8.0080 108.2200 52.2011 32.1568 177.4279 20 N 4.0076 8.3922 116.2735 54.3591 39.6895 171.8629 21 Y 5.4099 8.1503 114.1385 59.2121 41.5040 173.6097 22 A 4.4707 8.9642 120.6099 51.6858 24.4929 173.6130 23 T 4.0794 8.1739 110.9800 60.7733 70.3248 170.9227 24 E 4.5045 7.9409 125.2271 55.3709 34.1484 173.6711 25 K 5.5693 8.4336 121.0933 55.4358 35.4944 175.9350 26 N 4.8606 8.8740 122.3844 51.4361 40.7808 175.0824 27 K 4.4175 8.3418 118.8124 56.3839 32.7452 181.4662 28 R 3.1701 7.9213 114.7667 57.9432 30.5194 177.4030 29 N 4.3234 7.9749 120.0846 56.1959 39.8771 175.2913 30 T 3.7422 8.3092 115.3431 64.7446 69.3351 174.8161 31 P 3.9833 0.0000 0.0000 62.8715 27.2039 173.6693 32 N 4.6839 7.1833 115.6615 51.6482 41.9754 172.6967 33 K 4.1241 9.5414 128.7685 58.5939 33.3959 174.9375 34 L 3.9113 8.3877 122.0104 53.4653 40.1296 173.5319 35 E 5.5188 7.8581 119.3797 56.1540 32.4796 175.1561 36 L 5.9372 8.6433 126.9999 53.6675 43.6692 175.8895 37 R 4.6223 8.8001 117.1589 54.6245 32.5777 174.5144 38 K 4.1731 8.7331 123.7133 57.8386 32.7759 174.8564 39 Y 4.6862 8.8191 124.4787 56.7934 42.8480 172.5745 40 C 4.4034 8.0390 127.1852 57.8484 32.1697 171.2918 41 P 5.0281 0.0000 0.0000 62.7223 30.2288 175.8953 42 W 5.1065 8.9708 114.0853 55.5880 28.6618 176.3475 43 C 4.4583 7.8189 113.6347 57.4343 29.4483 172.7594 44 R 4.1192 8.0699 126.3350 55.3788 28.5543 175.3615 45 K 4.0490 7.7960 118.2569 57.7081 31.4116 174.4260 46 H 3.9036 8.5080 121.0379 56.4273 25.6124 174.0133 47 T 4.9303 8.5776 122.6656 62.0304 71.5232 174.4733 48 V 4.0203 8.3832 112.5114 63.1298 33.5741 173.7942 49 H 5.5869 8.0398 118.9093 56.4534 29.4727 173.4774 50 R 5.6259 8.0565 118.6303 55.7018 31.1820 177.9418 51 E 4.8812 8.7213 130.3179 56.4012 30.2955 175.9175 52 V 3.5830 8.7467 127.6949 63.6879 31.6209 171.0047 *53 K 4.1330 8.3254 122.9783 54.8458 32.2491 176.6690 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 9 L 8.04 4.33 0.00 1.74 1.78 0.92 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.47 4.94 0.00 1.62 1.55 0.90 0.62 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 11 L 8.97 5.01 0.00 1.55 1.55 0.99 0.85 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 12 E 8.37 5.02 0.00 2.30 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 2.51 2.32 0.00 13 C 8.97 4.87 0.00 2.83 2.92 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 0.00 0.00 0.00 14 T 8.38 4.80 4.03 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 0.00 0.00 1.24 0.00 0.00 15 E 8.84 3.84 0.00 2.03 1.83 0.00 0.00 0.00 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 2.19 0.00 16 C 6.68 3.96 0.00 3.16 3.17 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 0.00 0.00 0.00 0.00 17 K 7.71 4.45 0.00 1.80 2.07 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.18 1.08 7.81 18 R 6.98 4.64 0.00 1.96 1.46 0.00 2.93 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 19 R 8.01 4.05 0.00 1.93 2.02 0.00 3.38 0.00 0.00 3.52 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 20 N 8.39 4.01 0.00 3.00 2.83 0.00 0.00 6.77 7.54 0.00 0.00 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 Y 8.15 5.41 0.00 2.95 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.96 4.47 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.17 4.08 4.21 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 0.00 0.00 0.00 1.19 0.00 0.00 24 E 7.94 4.50 0.00 1.81 1.79 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 2.19 2.18 0.00 25 K 8.43 5.57 0.00 1.55 1.66 0.00 1.77 0.00 0.00 2.34 0.00 0.00 2.70 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.28 7.81 26 N 8.87 4.86 0.00 2.57 2.73 0.00 0.00 7.02 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 8.34 4.42 0.00 1.71 1.78 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.36 7.81 28 R 7.92 3.17 0.00 1.86 1.83 0.00 3.21 0.00 0.00 3.22 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 29 N 7.97 4.32 0.00 2.71 2.80 0.00 0.00 6.83 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.31 3.74 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 31 P 0.00 3.98 0.00 2.08 2.12 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 32 N 7.18 4.68 0.00 2.72 2.92 0.00 0.00 7.31 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 9.54 4.12 0.00 1.89 1.92 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.13 7.81 34 L 8.39 3.91 0.00 1.72 2.03 0.93 0.92 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 35 E 7.86 5.52 0.00 2.10 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 2.12 2.14 0.00 36 L 8.64 5.94 0.00 1.69 1.66 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.80 4.62 0.00 1.84 1.91 0.00 3.06 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 1.53 1.52 0.00 38 K 8.73 4.17 0.00 1.85 1.88 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.71 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.72 7.81 39 Y 8.82 4.69 0.00 2.89 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.04 4.40 0.00 2.59 2.42 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 41 P 0.00 5.03 0.00 2.36 1.86 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 42 W 8.97 5.11 0.00 3.43 2.97 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 43 C 7.82 4.46 0.00 2.79 2.36 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 44 R 8.07 4.12 0.00 1.90 2.29 0.00 3.38 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.50 0.00 45 K 7.80 4.05 0.00 1.96 1.96 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.39 7.81 46 H 8.51 3.90 0.00 3.26 3.37 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.58 4.93 4.21 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 0.00 0.00 0.00 1.20 0.00 0.00 48 V 8.38 4.02 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 0.85 0.00 0.00 0.96 0.00 0.00 49 H 8.04 5.59 0.00 3.47 3.41 0.00 6.03 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.06 5.63 0.00 1.76 0.88 0.00 3.37 0.00 0.00 3.89 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 51 E 8.72 4.88 0.00 1.91 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 52 V 8.75 3.58 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 0.76 0.00 0.00 0.99 0.00 0.00 *53 K 8.33 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.