NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2567 8.3027 121.4656 56.2634 32.0160 175.6374 20 I 4.0611 7.6031 121.5746 57.8937 36.3131 172.6393 21 D 4.9603 7.2244 128.7395 53.8072 44.7937 176.4899 22 Y 4.3854 8.0671 125.2415 59.3132 38.6250 177.0169 23 K 3.9927 7.5053 119.5947 59.3373 33.2486 176.7175 24 D 4.6070 7.4177 120.1405 53.0165 40.7989 176.9325 25 I 3.6681 7.8864 121.9386 64.5187 37.9537 175.8175 26 A 3.9843 8.0016 119.7715 55.8673 18.4800 179.3899 27 T 4.1096 8.4621 114.0554 66.6220 68.4568 177.1971 28 L 4.2658 7.9305 120.7791 57.4982 41.4494 179.2034 29 K 3.9482 7.8393 117.3831 58.8113 32.0477 178.4734 30 N 4.3317 7.6982 116.2282 55.4728 39.3607 175.9203 31 Y 4.6044 7.8866 118.2993 57.3115 38.1932 176.6020 32 I 5.2689 7.3035 119.8773 59.1732 40.1131 175.5326 33 T 3.9905 8.4923 120.3589 61.8903 67.7714 174.2647 34 E 3.9386 8.9139 125.0434 60.0117 29.8565 179.3474 35 S 4.2239 8.3462 114.2527 61.3001 62.9842 175.9611 36 G 4.2538 6.8932 118.1155 45.9562 0.0000 172.6947 37 K 4.4690 7.4558 121.0463 56.3783 34.9683 175.4285 38 I 5.2428 7.9856 112.7710 58.6743 39.6176 175.5384 39 V 3.9596 8.2256 124.2718 61.7911 32.1592 174.0715 40 P 4.4448 0.0000 0.0000 62.7915 31.5445 176.7609 41 S 4.2633 8.4742 111.8499 59.9314 63.9965 176.5697 42 R 4.0930 7.9886 120.5649 58.9205 30.5822 178.3382 43 I 3.7027 7.9876 117.0085 64.3664 37.0692 177.0580 44 T 4.2068 7.4886 107.7858 61.1023 69.4295 175.7849 45 G 3.9529 8.0893 109.6112 45.6552 0.0000 173.9404 46 T 4.1051 7.5270 108.9708 61.0949 69.3935 174.2012 47 R 4.1154 8.3551 121.2425 56.1330 31.0603 177.6783 48 A 4.0331 8.2860 120.1491 54.9225 18.6387 179.4236 49 K 3.6938 7.8781 116.5262 60.0824 32.3478 177.7030 50 Y 4.6584 7.6738 115.8879 60.6044 38.3321 177.2179 51 Q 3.9188 7.8681 120.2373 59.3977 28.7395 178.8024 52 R 3.9520 8.1692 118.9611 59.4765 30.0151 179.0083 53 Q 4.0583 7.9575 117.1759 58.5540 28.7755 177.7817 54 L 4.4695 8.1617 121.2749 57.2119 41.5782 179.2336 55 A 3.9714 7.9253 119.4824 55.5541 18.5133 179.8441 56 R 3.8576 7.7191 115.8971 59.4093 29.9758 179.2448 57 A 4.1328 8.9113 121.6179 55.1096 18.4026 179.7253 58 I 3.6748 8.0029 118.4610 64.5110 37.1454 178.6267 59 K 3.8422 8.2526 119.4392 59.6017 31.6936 179.3762 60 R 3.9071 7.6674 116.1309 59.4101 30.2303 178.5307 61 A 4.2113 7.8369 120.2877 55.2170 18.2147 179.8677 62 R 4.2987 7.8162 117.6839 59.1613 29.8657 179.1523 63 Y 4.6923 7.8388 111.4128 58.4830 37.4531 176.7038 64 L 4.6703 7.7954 117.5892 54.2606 43.9441 176.2336 65 S 3.8233 8.4560 109.9306 59.2219 61.7950 172.9434 66 L 4.3376 8.2032 119.7610 56.5525 41.8717 176.7688 67 L 4.6420 7.3688 117.7452 52.6677 45.6095 173.2819 68 P 4.8813 0.0000 0.0000 62.6377 32.8185 175.6084 69 Y 4.1530 8.7290 116.0156 59.5302 38.8996 176.7555 70 T 4.4924 7.6126 112.2246 59.7418 70.4895 173.6789 71 D 4.4097 8.9586 127.8672 56.8692 41.4289 177.6889 72 R 4.0168 8.0887 117.0978 58.8235 30.2670 175.6431 73 H 4.4417 8.2417 120.8180 56.1121 29.9538 173.0403 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 19 E 8.30 4.26 0.00 1.92 1.68 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 2.01 2.00 0.00 20 I 7.60 4.06 1.87 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 1.27 1.03 0.80 0.00 0.00 21 D 7.22 4.96 0.00 2.66 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 22 Y 8.07 4.39 0.00 3.19 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.51 3.99 0.00 1.73 1.60 0.00 1.42 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.24 1.31 7.81 24 D 7.42 4.61 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.89 3.67 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 1.59 1.07 0.98 0.00 0.00 26 A 8.00 3.98 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 27 T 8.46 4.11 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 28 L 7.93 4.27 0.00 1.84 1.80 0.99 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.84 3.95 0.00 1.82 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.80 7.81 30 N 7.70 4.33 0.00 2.10 2.27 0.00 0.00 6.90 8.23 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 31 Y 7.89 4.60 0.00 3.09 2.95 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 32 I 7.30 5.27 1.88 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 1.31 0.51 0.98 0.00 0.00 33 T 8.49 3.99 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 34 E 8.91 3.94 0.00 1.97 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 2.32 2.42 0.00 35 S 8.35 4.22 0.00 3.89 3.92 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 36 G 6.89 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.46 4.47 0.00 1.85 1.99 0.00 1.49 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.45 7.81 38 I 7.99 5.24 1.90 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 1.23 1.81 0.90 0.00 0.00 39 V 8.23 3.96 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 0.84 0.00 0.00 0.96 0.00 0.00 40 P 0.00 4.44 0.00 2.24 2.02 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 41 S 8.47 4.26 0.00 4.01 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 0.00 42 R 7.99 4.09 0.00 1.91 2.01 0.00 3.16 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 43 I 7.99 3.70 1.91 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 1.49 0.75 0.92 0.00 0.00 44 T 7.49 4.21 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 45 G 8.09 3.95 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 0.00 46 T 7.53 4.11 4.27 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 1.41 0.00 0.00 47 R 8.36 4.12 0.00 1.90 1.78 0.00 3.20 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 48 A 8.29 4.03 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 49 K 7.88 3.69 0.00 1.60 1.55 0.00 1.61 0.00 0.00 1.30 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.49 7.81 50 Y 7.67 4.66 0.00 3.01 2.79 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 0.00 0.00 0.00 51 Q 7.87 3.92 0.00 2.32 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 52 R 8.17 3.95 0.00 1.92 1.98 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 53 Q 7.96 4.06 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 54 L 8.16 4.47 0.00 1.79 1.56 0.80 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.93 3.97 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 56 R 7.72 3.86 0.00 2.01 2.02 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.95 0.00 57 A 8.91 4.13 1.41 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 0.00 0.00 58 I 8.00 3.67 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.09 0.87 0.00 0.00 59 K 8.25 3.84 0.00 2.01 2.10 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.70 7.81 60 R 7.67 3.91 0.00 1.82 1.44 0.00 3.35 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.95 0.00 61 A 7.84 4.21 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.82 4.30 0.00 1.57 1.10 0.00 2.67 0.00 0.00 2.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.52 0.00 63 Y 7.84 4.69 0.00 3.06 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 64 L 7.80 4.67 0.00 1.81 1.63 0.78 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.46 3.82 0.00 4.13 4.02 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 0.00 0.00 0.00 66 L 8.20 4.34 0.00 1.87 1.83 1.10 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.37 4.64 0.00 1.64 1.47 0.95 1.02 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 68 P 0.00 4.88 0.00 2.22 2.09 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 69 Y 8.73 4.15 0.00 2.83 3.02 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 0.00 0.00 0.00 70 T 7.61 4.49 4.28 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 1.27 0.00 0.00 71 D 8.96 4.41 0.00 2.89 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 72 R 8.09 4.02 0.00 1.86 2.04 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 73 H 8.24 4.44 0.00 3.08 3.11 0.00 5.78 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