NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *15 F 4.6644 8.3249 119.0081 55.8769 40.4981 174.3370 16 E 4.7099 7.9412 117.8938 54.8029 32.9750 173.3675 17 K 4.6480 8.6132 120.2547 54.6336 35.5809 175.7424 18 R 4.5061 8.3583 121.6761 54.4200 32.7786 173.7449 19 L 4.6523 8.6248 126.6278 53.0146 44.1142 174.6824 20 E 4.6711 8.7734 126.3005 54.2658 31.8559 174.7683 21 I 4.4440 8.2834 125.8711 59.5784 40.4610 174.7862 22 S 4.8352 8.3036 120.7692 56.7034 65.0466 173.4298 23 F 4.7932 8.3213 120.9641 55.0802 41.9125 175.5568 24 V 3.6717 8.3876 123.1666 63.0384 31.8042 175.4472 25 E 4.3019 8.7181 127.1480 54.7628 29.6910 174.7230 26 P 4.2490 0.0000 0.0000 63.2433 31.6818 177.0789 27 G 4.0594 8.4046 112.8674 44.9819 0.0000 173.8823 28 L 3.9172 8.3032 118.3951 57.0424 42.2076 177.9699 29 F 4.5236 6.9564 120.1370 55.6355 37.3431 175.3261 *34 G 3.7028 7.6352 108.0413 45.2129 0.0000 170.5213 35 K 4.5886 8.5904 123.8775 54.4108 35.5535 175.6493 36 G 4.1856 8.0391 109.8580 43.3223 0.0000 174.0586 37 L 3.9469 8.2542 117.6692 57.7619 41.5716 179.7136 38 R 4.2063 7.9103 115.7229 57.8136 30.0636 177.2512 39 S 4.4078 7.7452 112.0031 59.0618 63.6897 174.8206 40 L 4.2921 7.5076 121.7025 54.7046 42.1137 177.3847 41 S 4.5903 9.0847 117.7215 57.1883 65.6048 175.3363 42 K 3.8735 8.4590 121.5360 59.4446 31.5759 178.3050 43 A 4.1294 7.8306 119.9693 54.8462 18.7981 179.1203 44 Q 4.6997 7.6403 118.0708 58.5868 28.6668 178.7790 45 L 3.9899 7.8620 120.0362 57.6688 41.5369 178.9885 46 D 4.3705 7.6540 116.9484 56.5348 40.8387 178.2252 47 E 3.9973 8.0603 119.3571 58.4381 29.1997 178.8963 48 I 3.9095 7.3320 118.7674 63.8809 38.0718 177.7174 49 L 4.2509 8.2636 119.9592 56.9813 41.3630 179.5360 50 G 3.7004 8.1735 106.5486 47.5418 0.0000 173.8840 51 P 4.1828 0.0000 0.0000 64.8820 31.4672 177.4715 52 A 4.0920 7.9091 118.1610 52.2534 19.3870 176.1303 53 E 3.7645 8.0465 114.2461 57.6288 26.6509 173.3008 54 C 5.3452 8.3795 115.2981 58.2677 32.8290 175.5575 55 T 4.7372 8.5087 109.7603 60.1509 72.3292 172.8127 56 I 4.5783 8.3153 124.1285 61.2805 37.6226 176.0652 57 V 4.3996 8.4425 119.0006 61.2140 33.6141 174.5329 58 D 4.6477 7.7517 118.9324 54.0448 44.5203 173.3609 59 N 4.9948 8.5628 116.3683 52.4172 39.8771 173.6961 60 L 4.5234 8.1602 121.3875 54.1754 45.8986 174.4752 61 S 5.1687 8.6741 120.9461 57.0593 66.8074 172.7105 62 N 5.2137 8.6747 118.8562 52.0570 41.4663 174.7914 63 D 4.8346 8.6403 119.3860 53.9769 39.8104 175.9820 64 Y 4.6294 8.0540 116.3144 59.6191 40.4562 175.9390 65 V 4.5934 7.5301 116.5864 60.0672 34.6548 172.8921 66 D 5.1350 8.6286 120.4693 52.4978 42.8734 175.7648 67 S 4.8232 8.3314 118.1992 56.7050 65.9629 172.7976 68 Y 5.2336 8.3247 118.3237 56.4413 42.0881 174.6062 69 V 4.1882 8.6651 123.4730 61.9097 32.9415 174.5780 70 L 5.2540 8.6132 128.0934 53.2987 43.7055 175.9075 71 S 4.8595 9.0254 117.7144 56.6019 65.8143 174.2867 72 E 4.4116 8.5855 120.5112 56.6870 29.9021 175.8560 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 *15 F 8.32 4.66 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.94 4.71 0.00 1.98 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 2.20 2.40 0.00 17 K 8.61 4.65 0.00 1.71 1.69 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.38 7.81 18 R 8.36 4.51 0.00 1.70 1.75 0.00 3.18 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 19 L 8.62 4.65 0.00 1.58 1.52 0.91 0.90 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 20 E 8.77 4.67 0.00 1.92 1.77 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 2.15 2.28 0.00 21 I 8.28 4.44 1.85 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 1.32 0.76 0.31 0.00 0.00 22 S 8.30 4.84 0.00 3.75 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 23 F 8.32 4.79 0.00 3.01 2.98 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 24 V 8.39 3.67 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 0.84 0.00 0.00 0.97 0.00 0.00 25 E 8.72 4.30 0.00 2.03 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 2.35 2.38 0.00 26 P 0.00 4.25 0.00 2.05 2.05 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 27 G 8.40 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.30 3.92 0.00 0.66 1.26 0.72 0.63 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 29 F 6.96 4.52 0.00 3.26 2.99 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 0.00 0.00 0.00 *34 G 7.64 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 35 K 8.59 4.59 0.00 1.67 1.66 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.43 7.81 36 G 8.04 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.25 3.95 0.00 1.71 1.71 0.98 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 38 R 7.91 4.21 0.00 1.81 2.01 0.00 3.55 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 39 S 7.75 4.41 0.00 3.98 3.96 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 40 L 7.51 4.29 0.00 1.68 1.62 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 41 S 9.08 4.59 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 3.87 0.00 1.82 1.84 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.46 7.81 43 A 7.83 4.13 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.64 4.70 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.23 0.00 45 L 7.86 3.99 0.00 1.68 1.51 0.64 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.65 4.37 0.00 2.88 2.68 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 0.00 0.00 0.00 0.00 47 E 8.06 4.00 0.00 2.22 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 2.53 0.00 48 I 7.33 3.91 2.02 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 1.64 0.63 0.92 0.00 0.00 49 L 8.26 4.25 0.00 1.63 1.82 0.82 0.90 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 50 G 8.17 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 51 P 0.00 4.18 0.00 2.05 2.13 0.00 3.80 0.00 0.00 3.66 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 52 A 7.91 4.09 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 53 E 8.05 3.76 0.00 2.14 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 0.00 2.23 2.41 0.00 54 C 8.38 5.35 0.00 2.78 2.77 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 55 T 8.51 4.74 4.23 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 0.00 0.00 1.20 0.00 0.00 56 I 8.32 4.58 1.85 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.43 1.10 0.00 0.00 57 V 8.44 4.40 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 0.66 0.00 0.00 0.99 0.00 0.00 58 D 7.75 4.65 0.00 2.72 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.56 4.99 0.00 2.43 2.87 0.00 0.00 5.73 7.79 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 60 L 8.16 4.52 0.00 1.72 1.42 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.67 5.17 0.00 3.70 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 62 N 8.67 5.21 0.00 2.94 2.97 0.00 0.00 6.89 7.91 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 63 D 8.64 4.83 0.00 2.54 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 8.05 4.63 0.00 2.95 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 65 V 7.53 4.59 2.14 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 0.78 0.00 0.00 0.96 0.00 0.00 66 D 8.63 5.13 0.00 2.63 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 4.82 0.00 3.82 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.32 5.23 0.00 2.79 2.84 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 0.00 0.00 0.00 69 V 8.67 4.19 2.12 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 1.06 0.00 0.00 0.95 0.00 0.00 70 L 8.61 5.25 0.00 1.58 1.57 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 71 S 9.03 4.86 0.00 3.85 3.96 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 72 E 8.59 4.41 0.00 1.94 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 2.20 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.