NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.8562 8.1545 117.9084 61.2738 32.4951 172.5555 3 N 4.6023 8.8181 122.4287 51.3456 35.2943 170.1722 4 V 4.0335 8.6006 123.1472 59.7075 34.5183 170.6839 5 P 4.3202 0.0000 0.0000 62.0758 29.5531 175.6462 6 K 3.5350 8.2183 126.2746 57.0247 31.9507 172.4897 7 T 5.4206 7.8287 113.4072 59.6650 71.4964 176.9571 8 R 4.5711 8.5478 128.3931 54.7412 33.5072 172.0782 9 K 3.9442 9.1438 131.0883 55.2592 30.8463 174.9728 10 T 4.2229 7.6997 126.1211 62.9597 68.7043 177.2560 *11 Y 3.0506 8.7870 124.3483 56.2368 38.8753 178.0078 12 C 4.2355 9.2476 121.7980 57.1407 39.4951 174.5658 13 K 4.3441 7.5922 122.9350 56.4415 35.1502 172.4569 14 G 4.4904 8.7441 117.9763 48.3242 0.0000 173.8229 15 K 4.1669 8.5070 120.9288 54.4076 30.5153 179.7980 16 T 3.6034 9.2786 106.9229 62.8374 65.8929 174.8521 17 C 4.6102 8.1569 125.1576 52.4905 48.0674 178.7111 18 R 3.9747 9.0459 122.9878 56.9181 29.5965 180.3749 19 K 3.9703 8.5569 116.6576 56.9434 28.8933 174.3259 *20 H 5.4338 8.5941 115.7959 55.1257 30.2044 171.3408 21 T 4.8145 8.2052 120.1180 63.4673 71.3210 169.8138 22 Q 4.1176 8.4581 130.3291 56.4196 29.4873 172.4525 *23 H 5.0804 8.7751 123.9882 52.6685 30.4587 170.9451 24 K 4.1039 8.9110 130.1612 55.3874 32.4995 173.8215 25 V 4.6860 8.0308 128.2466 59.0642 32.6466 173.1603 26 T 4.5026 8.3364 123.8557 60.4346 70.7850 172.3507 27 Q 4.9313 8.4909 122.6571 56.4247 29.8470 175.7250 *28 Y 4.2840 8.7804 122.9860 58.1156 37.6041 178.1632 29 K 4.6189 8.5100 122.2367 54.6338 32.7994 174.2680 30 A 5.0255 7.9065 121.2170 53.7408 21.7114 175.0590 31 G 3.8070 8.2382 102.0906 45.5387 0.0000 174.6241 32 K 4.2347 8.7641 126.6813 54.8208 31.9359 172.2007 33 A 4.2224 8.5561 119.9315 56.3045 21.7496 178.7580 34 S 3.5447 8.4700 112.7440 60.6665 58.9736 174.6673 35 L 3.9523 8.8869 130.9003 54.3570 38.0079 171.5696 *36 F 4.5790 7.3554 114.9688 58.6880 40.6269 179.4134 37 A 3.9908 7.9259 123.7324 52.3055 19.5537 178.3710 38 Q 4.0377 9.2134 126.7374 61.1563 28.2481 177.7598 39 G 4.2537 7.8739 109.9198 47.8917 0.0000 176.4985 40 K 4.0844 8.2964 128.5474 60.5415 31.8764 182.1506 41 R 4.0950 8.0749 123.8577 61.0589 29.4805 180.3637 42 R 4.7676 7.9858 121.4085 60.5507 31.2816 180.2942 *43 Y 4.2301 7.8067 116.6680 58.1999 36.6512 178.3705 44 D 4.7342 8.1619 122.2110 54.8583 39.7598 181.2969 45 R 4.3638 7.5839 131.3847 56.8261 34.2766 172.1761 46 K 4.3655 10.4047 124.1170 57.6557 28.7827 175.1550 47 Q 4.0851 9.6933 118.9547 55.4782 24.5552 176.5806 48 S 4.5819 7.8092 112.0480 59.4361 67.7316 178.6235 49 G 3.6369 8.2736 109.5308 48.1697 0.0000 173.5568 *50 F 4.7387 7.2809 117.1380 56.5862 43.5545 180.4754 51 G 4.1999 8.2254 111.7931 45.7322 0.0000 173.0458 52 G 4.0336 8.9866 120.6769 42.9947 0.0000 177.2166 53 Q 5.1309 6.3073 124.0818 55.0597 29.7296 178.6835 54 T 4.7805 8.2384 111.4039 61.2005 72.1946 174.4187 55 K 4.4372 8.2826 129.1458 56.7245 32.3321 174.6339 56 P 4.8405 0.0000 0.0000 60.2945 30.3108 178.1514 57 V 4.6263 7.1350 123.2049 58.9320 33.8219 173.9732 *58 F 4.4587 7.7885 121.5692 57.1086 42.3730 175.1401 *59 H 4.2599 8.5918 119.3289 56.7910 28.6878 181.0361 60 K 4.3500 8.2760 129.6285 53.7676 31.9423 178.0494 61 K 4.2073 8.7519 122.8113 54.7597 33.4185 176.5078 62 A 4.3465 8.5317 132.4463 51.8111 18.9812 176.9898 63 K 4.4432 8.4107 116.9216 54.3299 34.1109 172.7642 64 T 3.4588 8.2573 109.7617 63.2327 65.5133 178.8354 65 T 4.4351 7.5489 111.8184 61.3733 71.0909 179.1774 66 K 4.5114 8.3938 135.0000 53.9126 31.6320 176.5148 67 K 4.6991 8.2808 120.2893 55.1805 35.6747 173.6048 68 V 3.8489 8.3410 121.7591 62.0191 32.5644 179.1774 69 V 4.3468 8.0689 131.6411 59.1362 29.9712 172.9176 70 L 4.1737 7.8559 128.4975 56.2534 41.7963 180.6889 71 R 5.0283 8.9539 126.2952 54.5839 29.5480 172.7401 72 L 4.1908 8.3081 128.8824 56.1140 43.3072 179.5236 73 E 4.7896 8.3108 118.5455 56.5655 33.9482 175.4280 74 C 5.4338 8.9656 124.8318 54.1258 41.1092 170.6662 75 V 4.2132 8.1863 113.9303 63.6274 34.3063 175.0582 76 K 4.1789 8.2791 122.6890 58.5715 32.0387 183.6449 77 C 4.1213 8.3958 118.8147 56.4386 39.8326 178.6340 78 K 3.8577 7.9570 117.9904 56.6230 30.6446 181.4117 79 T 4.2342 7.2314 109.0570 62.0152 72.7123 178.6942 80 R 4.5896 8.1867 118.1322 55.2537 32.9158 175.4735 81 A 4.0017 8.1434 128.8387 50.3784 17.1056 176.3393 82 Q 4.5425 9.5519 125.5061 55.7361 29.7458 174.1616 83 L 4.6034 8.6580 129.0433 54.7956 42.2580 173.4500 84 T 4.7870 9.1933 118.4362 60.5264 72.9212 174.6222 85 L 4.5568 8.4543 122.0383 56.1941 43.0452 171.7090 86 K 4.5376 8.5470 131.9494 54.1114 33.8696 175.0768 87 R 4.7265 9.4320 125.8636 55.4755 32.7501 174.0090 88 C 5.8082 8.0317 135.0000 57.4942 30.3013 170.2673 89 K 4.7108 8.1489 129.0333 52.6803 35.2131 173.2982 *90 H 4.8647 8.4510 119.6479 54.4305 30.0081 175.5271 *91 F 4.7088 7.6079 117.8549 61.0448 42.1000 173.0559 92 E 4.7408 8.4681 113.7731 58.2601 33.7323 173.7474 93 L 4.6037 8.0479 118.0340 55.7498 42.7328 175.8644 94 G 3.9086 8.7751 107.2115 46.9897 0.0000 172.1082 95 G 3.5537 8.5418 118.6119 47.0352 0.0000 173.9373 96 E 4.2504 8.2227 119.7263 55.5729 30.8087 177.5874 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 2 V 8.15 3.86 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 0.90 0.00 0.00 0.93 0.00 0.00 3 N 8.82 4.60 0.00 2.89 2.76 0.00 0.00 6.74 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 V 8.60 4.03 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 0.89 0.00 0.00 0.93 0.00 0.00 5 P 0.00 4.32 0.00 2.24 2.14 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.56 0.00 6 K 8.22 3.54 0.00 1.67 1.70 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.46 1.04 7.81 7 T 7.83 5.42 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 8 R 8.55 4.57 0.00 1.53 1.66 0.00 3.26 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.20 0.00 9 K 9.14 3.94 0.00 1.53 1.71 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.68 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.37 1.04 7.81 10 T 7.70 4.22 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 *11 Y 8.79 3.05 0.00 2.31 2.33 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 12 C 9.25 4.24 0.00 2.91 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 13 K 7.59 4.34 0.00 1.76 0.80 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.11 0.79 7.81 14 G 8.74 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 0.00 0.00 0.00 0.00 15 K 8.51 4.17 0.00 1.78 1.09 0.00 1.96 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.28 0.98 7.81 16 T 9.28 3.60 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 17 C 8.16 4.61 0.00 2.66 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.05 3.97 0.00 1.99 1.86 0.00 3.28 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.18 0.00 19 K 8.56 3.97 0.00 1.96 1.74 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.22 0.98 7.81 *20 H 8.59 5.43 0.00 2.91 2.91 0.00 7.20 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.21 4.81 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 22 Q 8.46 4.12 0.00 1.73 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.82 0.00 0.00 0.00 0.00 0.00 2.37 1.96 0.00 *23 H 8.78 5.08 0.00 2.54 2.92 0.00 7.16 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.91 4.10 0.00 1.48 1.76 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.27 7.81 25 V 8.03 4.69 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 1.02 0.00 0.00 0.93 0.00 0.00 26 T 8.34 4.50 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 27 Q 8.49 4.93 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.99 0.00 0.00 0.00 0.00 0.00 2.22 1.92 0.00 *28 Y 8.78 4.28 0.00 2.04 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 0.00 0.00 0.00 0.00 29 K 8.51 4.62 0.00 1.74 1.47 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.26 0.97 7.81 30 A 7.91 5.03 1.23 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 0.00 0.00 0.00 31 G 8.24 3.81 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 0.00 0.00 0.00 32 K 8.76 4.23 0.00 1.79 1.63 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.01 7.81 33 A 8.56 4.22 1.25 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 34 S 8.47 3.54 0.00 3.72 4.07 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 35 L 8.89 3.95 0.00 1.85 1.74 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 *36 F 7.36 4.58 0.00 2.43 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 0.00 0.00 0.00 0.00 37 A 7.93 3.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.21 4.04 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.02 0.00 39 G 7.87 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 40 K 8.30 4.08 0.00 1.78 1.81 0.00 1.83 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.07 7.81 41 R 8.07 4.09 0.00 1.86 1.88 0.00 3.20 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 42 R 7.99 4.77 0.00 1.88 1.83 0.00 3.24 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.47 0.00 *43 Y 7.81 4.23 0.00 2.34 2.22 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 44 D 8.16 4.73 0.00 2.70 2.54 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 45 R 7.58 4.36 0.00 1.76 1.53 0.00 3.25 0.00 0.00 3.26 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.10 0.00 46 K 10.40 4.37 0.00 1.86 1.92 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.15 0.74 7.81 47 Q 9.69 4.09 0.00 2.18 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.71 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 48 S 7.81 4.58 0.00 3.60 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.27 3.64 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 0.00 0.00 0.00 *50 F 7.28 4.74 0.00 2.42 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 0.00 0.00 0.00 51 G 8.23 4.20 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 0.00 0.00 0.00 52 G 8.99 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 0.00 0.00 0.00 0.00 53 Q 6.31 5.13 0.00 2.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.65 0.00 0.00 0.00 0.00 0.00 2.05 1.64 0.00 54 T 8.24 4.78 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 55 K 8.28 4.44 0.00 1.78 1.74 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.07 7.81 56 P 0.00 4.84 0.00 2.06 1.87 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.55 0.00 57 V 7.13 4.63 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 0.77 0.00 0.00 0.93 0.00 0.00 *58 F 7.79 4.46 0.00 2.23 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 0.00 0.00 0.00 0.00 *59 H 8.59 4.26 0.00 2.92 2.97 0.00 7.12 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 60 K 8.28 4.35 0.00 1.73 0.93 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 0.95 7.81 61 K 8.75 4.21 0.00 1.71 1.60 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.22 0.95 7.81 62 A 8.53 4.35 1.26 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 0.00 0.00 63 K 8.41 4.44 0.00 1.74 1.67 0.00 1.95 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.23 0.95 7.81 64 T 8.26 3.46 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 65 T 7.55 4.44 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 66 K 8.39 4.51 0.00 1.77 1.56 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.01 7.81 67 K 8.28 4.70 0.00 1.71 1.53 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.25 1.00 7.81 68 V 8.34 3.85 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 0.61 0.00 0.00 0.93 0.00 0.00 69 V 8.07 4.35 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 0.67 0.00 0.00 0.93 0.00 0.00 70 L 7.86 4.17 0.00 1.33 1.62 0.92 0.79 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 71 R 8.95 5.03 0.00 1.40 1.80 0.00 3.24 0.00 0.00 3.20 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.41 0.00 72 L 8.31 4.19 0.00 1.28 1.58 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.31 4.79 0.00 1.59 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 2.12 2.10 0.00 74 C 8.97 5.43 0.00 2.72 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.19 4.21 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 0.91 0.00 0.00 0.93 0.00 0.00 76 K 8.28 4.18 0.00 1.68 1.83 0.00 1.79 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.00 7.81 77 C 8.40 4.12 0.00 2.74 3.15 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 0.00 78 K 7.96 3.86 0.00 1.91 1.84 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.28 1.24 7.81 79 T 7.23 4.23 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 80 R 8.19 4.59 0.00 1.76 1.66 0.00 3.27 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 81 A 8.14 4.00 1.26 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 0.00 0.00 82 Q 9.55 4.54 0.00 1.71 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.92 0.00 0.00 0.00 0.00 0.00 2.24 2.17 0.00 83 L 8.66 4.60 0.00 1.43 1.47 0.92 0.78 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 84 T 9.19 4.79 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 85 L 8.45 4.56 0.00 1.36 1.45 0.92 0.65 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 86 K 8.55 4.54 0.00 1.47 1.70 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.32 1.26 7.81 87 R 9.43 4.73 0.00 1.53 1.69 0.00 3.40 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.17 0.00 88 C 8.03 5.81 0.00 2.83 2.85 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 0.00 0.00 0.00 89 K 8.15 4.71 0.00 1.71 1.54 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 0.96 7.81 *90 H 8.45 4.86 0.00 2.92 2.88 0.00 7.21 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *91 F 7.61 4.71 0.00 2.00 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 0.00 0.00 0.00 0.00 92 E 8.47 4.74 0.00 1.59 1.78 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 2.10 1.76 0.00 93 L 8.05 4.60 0.00 1.33 1.55 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.78 3.91 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 0.00 0.00 0.00 95 G 8.54 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 8.22 4.25 0.00 1.93 1.63 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 2.12 1.86 0.00 * Residues marked with a * may have inaccurate shift predictions.