NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4124 8.3301 116.8007 58.3707 64.0563 176.9895 23 A 4.1146 9.1246 130.4664 51.5883 20.7030 175.7042 24 L 3.7715 8.6032 124.3329 59.1210 42.3868 177.3483 25 H 4.0692 8.2102 113.6537 59.0896 28.1540 177.3638 26 W 5.0005 7.6950 120.8055 59.4703 28.8660 178.6846 27 R 4.0063 8.3662 118.1270 59.2290 29.7146 178.7388 28 A 4.1220 8.7540 120.6345 55.0548 18.2343 179.5467 29 A 4.0807 8.2666 119.4908 55.4157 18.5999 179.9172 30 G 3.6476 7.9896 103.9067 48.0849 0.0000 175.5647 31 A 4.0282 8.5858 123.2360 54.8421 18.3566 179.6141 32 A 4.0204 8.1244 119.3397 55.4226 18.4020 180.0240 33 T 3.9286 7.8685 114.6282 66.5256 68.5620 177.4171 34 V 3.5583 7.9532 120.3070 65.8755 31.5359 177.7803 35 L 3.9451 7.9809 120.1408 58.0415 41.8648 178.4506 36 L 3.8812 7.8717 120.2188 58.2706 42.0562 178.8123 37 V 3.6031 7.7444 117.8552 66.3368 31.3154 178.1499 38 I 3.6829 7.7519 119.0735 64.4977 37.0324 178.5359 39 V 3.6461 7.9837 119.1440 65.8740 31.2753 177.9160 40 L 3.9438 8.3960 119.0372 57.8732 41.6280 179.5725 41 L 4.0284 8.0766 118.4351 57.9399 41.5824 179.5993 42 A 4.2576 8.6146 121.1783 54.7857 18.1985 179.9302 43 G 3.7296 8.6970 104.9708 48.2379 0.0000 176.0173 44 S 4.4363 8.3223 118.0299 61.4996 62.8964 176.2621 45 Y 4.3811 8.2048 121.8033 61.0135 38.7162 177.9845 46 L 4.0374 8.7044 120.1103 57.5354 41.7063 179.4826 47 A 3.8632 8.5651 121.2288 55.2443 18.3892 179.7930 48 V 3.5428 7.4472 116.7789 66.0244 31.2471 177.9203 49 L 3.7913 7.5914 118.9324 57.9154 41.9352 178.5129 50 A 4.1306 7.7476 119.7389 55.0260 18.8741 179.1668 51 E 3.9946 8.5504 117.5028 58.0176 29.5039 177.7181 52 R 4.0440 7.3402 119.5996 57.2855 30.3782 176.1743 53 G 3.8940 8.8926 112.2123 45.1722 0.0000 172.9788 54 A 4.5067 7.9614 123.8264 49.3587 19.8417 174.5164 55 P 4.2796 0.0000 0.0000 64.9077 31.6849 176.9651 56 G 3.9255 8.9812 111.6924 45.0610 0.0000 173.5883 57 A 3.9937 7.6538 122.5792 52.8567 18.6277 177.2936 58 Q 4.4288 8.4425 118.9044 55.6847 31.0366 176.1163 59 L 4.2546 7.4787 122.3905 54.1574 40.6613 176.0073 60 I 4.3330 7.2828 108.7666 60.3561 38.8964 176.4697 61 T 4.3612 7.2598 110.9387 59.3188 72.7320 173.5947 62 Y 4.3195 8.0797 122.1175 61.1155 37.7931 177.0569 63 P 4.3949 0.0000 0.0000 66.0268 31.4426 178.8869 64 R 4.1688 8.1259 113.7892 59.2668 29.5330 178.4225 65 A 4.1820 8.2391 121.5162 54.8000 18.3102 179.3902 66 L 4.6789 8.4039 120.7563 57.7117 42.3130 178.9775 67 W 4.5067 8.2224 128.2233 59.9558 30.6918 177.9563 68 W 3.8202 8.6531 128.7248 60.1482 30.1148 177.7514 69 A 2.9924 8.0877 120.6882 55.0680 17.8954 179.2647 70 C 3.9060 7.9528 115.2999 62.9567 28.3108 176.1991 71 E 3.7838 7.2164 119.1252 57.8692 29.0190 179.1676 72 T 3.5497 6.9379 116.9803 66.2695 68.4678 176.5874 73 A 3.8172 7.5604 122.7552 55.2724 18.2643 178.8050 74 T 3.9251 7.6947 105.1556 62.5574 69.2930 176.3842 75 T 3.3733 7.7512 111.1959 61.9059 67.5935 172.9371 76 V 3.2686 7.9291 121.3534 65.5764 31.6913 178.4125 77 G 3.5780 7.3049 104.3111 47.0211 0.0000 174.8808 78 Y 4.3654 9.2845 123.5725 58.5470 37.7805 176.1882 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 22 S 8.33 4.41 0.00 3.97 3.45 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 0.00 0.00 0.00 23 A 9.12 4.11 1.24 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 0.00 0.00 24 L 8.60 3.77 0.00 1.77 1.66 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.21 4.07 0.00 3.26 3.45 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 7.69 5.00 0.00 3.42 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 27 R 8.37 4.01 0.00 2.03 2.00 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 28 A 8.75 4.12 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 29 A 8.27 4.08 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.99 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.59 4.03 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 32 A 8.12 4.02 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 0.00 0.00 0.00 0.00 0.00 33 T 7.87 3.93 4.42 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 1.21 0.00 0.00 34 V 7.95 3.56 2.08 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 0.99 0.00 0.00 0.94 0.00 0.00 35 L 7.98 3.95 0.00 1.95 1.81 0.92 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.87 3.88 0.00 1.97 1.85 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.74 3.60 2.23 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 0.98 0.00 0.00 0.98 0.00 0.00 38 I 7.75 3.68 2.05 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 1.40 0.62 0.91 0.00 0.00 39 V 7.98 3.65 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 0.85 0.00 0.00 0.99 0.00 0.00 40 L 8.40 3.94 0.00 1.90 1.73 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.08 4.03 0.00 1.83 1.73 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.61 4.26 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 43 G 8.70 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.32 4.44 0.00 4.27 4.22 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 45 Y 8.20 4.38 0.00 3.12 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.70 4.04 0.00 1.88 1.79 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.57 3.86 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.45 3.54 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 0.58 0.00 0.00 0.63 0.00 0.00 49 L 7.59 3.79 0.00 1.55 1.73 0.78 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.75 4.13 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 51 E 8.55 3.99 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 52 R 7.34 4.04 0.00 1.96 1.76 0.00 3.26 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 53 G 8.89 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.96 4.51 1.24 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 0.00 0.00 55 P 0.00 4.28 0.00 2.03 2.01 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 56 G 8.98 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.65 3.99 1.24 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 0.00 0.00 58 Q 8.44 4.43 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.49 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 59 L 7.48 4.25 0.00 1.25 1.29 0.56 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.28 4.33 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.76 0.85 0.00 0.00 61 T 7.26 4.36 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 1.14 0.00 0.00 62 Y 8.08 4.32 0.00 3.21 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 63 P 0.00 4.39 0.00 2.23 2.20 0.00 3.63 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 64 R 8.13 4.17 0.00 2.23 2.30 0.00 2.97 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 65 A 8.24 4.18 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.40 4.68 0.00 1.95 2.07 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 67 W 8.22 4.51 0.00 3.43 3.35 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 0.00 0.00 0.00 68 W 8.65 3.82 0.00 3.45 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 2.99 1.36 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 0.00 0.00 70 C 7.95 3.91 0.00 3.09 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 71 E 7.22 3.78 0.00 1.64 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 1.68 1.78 0.00 72 T 6.94 3.55 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 73 A 7.56 3.82 1.13 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 0.00 0.00 74 T 7.69 3.93 4.13 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 1.19 0.00 0.00 75 T 7.75 3.37 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 76 V 7.93 3.27 1.54 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 0.02 0.00 0.00 0.74 0.00 0.00 77 G 7.30 3.58 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 0.00 0.00 0.00 78 Y 9.28 4.37 0.00 3.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00