NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 Q 4.2484 8.4445 119.1183 54.3504 29.7776 174.7204 7 P 4.6756 0.0000 0.0000 58.5712 33.6020 169.7469 8 V 3.5991 8.3083 116.0889 64.3255 31.4165 173.8469 9 D 4.5045 8.5085 128.0903 53.9525 39.5785 176.8628 10 L 4.0739 8.3867 124.1975 56.3243 42.2780 179.0037 11 G 3.7240 8.1849 107.7683 48.1305 0.0000 175.0119 12 L 4.3527 9.4113 118.6128 54.0988 41.5227 176.2479 13 L 4.1594 7.5942 121.7983 53.9813 42.4709 176.0413 14 E 4.3270 8.5441 125.4956 55.6961 29.5383 176.6504 15 E 4.2527 8.6297 123.9068 55.5053 30.3986 177.7422 16 D 4.4349 8.6705 120.5904 56.4751 41.2835 176.5977 17 D 4.8968 7.7615 115.2739 53.1826 40.5301 177.0417 18 E 4.0986 7.8650 121.5683 55.1981 27.0533 176.0775 19 F 4.1337 7.5794 115.9063 57.1612 38.6252 175.9838 20 E 4.5201 8.5758 121.0519 54.6799 29.2385 175.5973 21 E 3.2937 8.5486 124.5007 58.6049 29.7977 177.1043 22 F 4.7890 7.3287 116.6588 54.9715 40.2675 171.7513 23 P 4.4414 0.0000 0.0000 61.3011 30.6171 175.6303 *37 H 4.4686 8.5828 116.7685 57.7490 29.4393 174.1939 38 V 3.7133 8.1953 127.7667 61.7004 30.5900 173.5195 39 W 4.7901 8.2894 135.0000 59.2528 35.9821 170.3660 40 E 3.4260 7.6283 128.4081 56.3133 28.4119 174.1627 41 D 4.0531 7.6560 119.5569 53.9002 42.1849 180.5284 42 N 4.5445 8.8986 122.4060 53.0555 38.3610 175.1300 43 W 4.0072 8.7714 131.0838 60.3158 31.1920 178.6859 44 D 4.9526 8.0860 117.9803 52.8747 38.1577 175.4886 45 D 4.8182 8.9953 120.2712 53.7120 40.9539 175.9075 46 D 4.9735 8.1676 121.4397 53.7685 42.4181 176.8432 47 N 4.7676 7.9715 117.1728 53.7769 38.6596 177.0144 48 V 4.4511 9.1229 114.0630 60.9607 33.1206 173.3981 49 E 4.7620 8.3182 115.2568 57.0572 31.5726 175.0442 50 D 4.3821 8.1586 118.6385 53.5853 40.9342 173.5580 51 D 4.3268 8.8330 119.4507 56.3467 41.1695 177.5779 52 F 4.6986 8.0118 115.4001 56.6395 41.1002 175.9097 53 S 3.8084 8.8357 115.3049 62.5340 62.8362 176.2094 54 N 4.3034 7.9731 122.7847 51.5721 39.1045 176.1687 55 Q 4.0643 8.8939 127.9251 56.4451 27.1806 172.5415 56 L 4.0051 8.1052 123.6220 57.0720 42.7683 175.4774 57 R 4.5324 9.1186 129.9124 56.9957 28.4215 177.4720 58 A 4.0525 7.7114 117.5055 55.4952 18.5030 178.5826 59 E 3.8617 8.4458 116.4095 59.3094 29.4334 178.9996 60 L 3.8428 7.7214 119.1884 58.5135 42.2094 179.2048 61 E 3.9366 7.7816 116.6780 59.2570 29.6670 179.6217 62 K 4.2468 8.0965 116.4665 59.2243 33.2763 176.8922 63 H 4.4806 7.8645 122.1531 56.4391 29.3306 174.7594 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 6 Q 8.44 4.25 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 7 P 0.00 4.68 0.00 2.14 1.84 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 8 V 8.31 3.60 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 0.90 0.00 0.00 0.92 0.00 0.00 9 D 8.51 4.50 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.39 4.07 0.00 1.66 1.72 0.91 1.03 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 11 G 8.18 3.72 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 0.00 0.00 0.00 12 L 9.41 4.35 0.00 1.70 1.69 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.59 4.16 0.00 1.57 1.56 0.91 0.96 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 E 8.54 4.33 0.00 1.98 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 2.30 2.22 0.00 15 E 8.63 4.25 0.00 1.99 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 2.37 2.39 0.00 16 D 8.67 4.43 0.00 2.60 2.69 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 17 D 7.76 4.90 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.86 4.10 0.00 2.04 1.84 0.00 0.00 0.00 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 2.32 0.00 19 F 7.58 4.13 0.00 2.89 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.58 4.52 0.00 2.00 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 2.28 2.25 0.00 21 E 8.55 3.29 0.00 1.61 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 22 F 7.33 4.79 0.00 2.97 3.01 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 23 P 0.00 4.44 0.00 2.10 2.12 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 *37 H 8.58 4.47 0.00 3.24 3.31 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.20 3.71 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.96 0.00 0.00 39 W 8.29 4.79 0.00 3.27 3.09 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 40 E 7.63 3.43 0.00 1.30 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 41 D 7.66 4.05 0.00 2.60 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.90 4.54 0.00 3.03 2.78 0.00 0.00 5.87 8.88 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 43 W 8.77 4.01 0.00 3.44 3.07 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 0.00 0.00 0.00 44 D 8.09 4.95 0.00 2.85 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 45 D 9.00 4.82 0.00 2.56 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.17 4.97 0.00 2.63 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 7.97 4.77 0.00 2.67 3.01 0.00 0.00 6.98 7.68 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 48 V 9.12 4.45 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 0.64 0.00 0.00 0.93 0.00 0.00 49 E 8.32 4.76 0.00 2.01 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 2.10 2.23 0.00 50 D 8.16 4.38 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.83 4.33 0.00 2.56 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.01 4.70 0.00 2.84 3.01 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 53 S 8.84 3.81 0.00 3.78 3.77 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 54 N 7.97 4.30 0.00 2.71 2.92 0.00 0.00 7.20 7.69 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 55 Q 8.89 4.06 0.00 2.16 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.31 6.97 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 56 L 8.11 4.01 0.00 1.58 1.60 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 57 R 9.12 4.53 0.00 1.92 2.34 0.00 3.24 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 58 A 7.71 4.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.45 3.86 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.33 0.00 60 L 7.72 3.84 0.00 1.69 1.77 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.78 3.94 0.00 2.20 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 2.55 2.51 0.00 62 K 8.10 4.25 0.00 1.84 1.84 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.61 7.81 63 H 7.86 4.48 0.00 3.26 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.91 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.