NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.3556 8.3449 119.6875 56.2340 30.2442 174.4084 4 Q 4.3087 7.5659 118.1497 55.2094 32.5739 172.2358 5 K 5.4189 8.2846 126.7811 56.9924 34.2456 172.1847 6 P 4.3266 0.0000 0.0000 64.2613 32.0572 176.8609 7 Q 4.5538 8.3073 121.6024 54.7466 27.4171 174.0870 8 L 5.0400 7.6002 121.5108 52.6956 46.4015 175.2027 9 V 4.4265 8.2954 121.9003 61.0813 35.0118 174.4805 10 Q 5.0084 8.7941 125.2062 54.7275 30.8438 174.7046 11 T 4.8352 8.9833 121.4251 61.4061 72.0400 173.5452 12 F 6.1843 7.7085 118.3900 54.2047 41.1711 174.2086 13 G 4.4549 8.7703 106.2488 44.9068 0.0000 171.2587 14 R 5.7472 8.4868 119.9550 55.2039 33.6155 174.6259 15 K 4.1736 8.8770 124.9045 56.9241 35.0361 175.7783 16 K 4.0181 9.5010 124.6482 57.9648 30.9126 173.7831 17 N 4.6034 8.1265 119.8780 53.7853 37.8663 175.1755 18 A 4.1159 8.8496 122.2004 51.8654 19.5233 176.5784 19 V 4.7332 8.5547 122.3109 61.0300 34.6507 173.9548 20 A 4.7798 9.5990 131.4737 50.2759 20.9832 175.7813 21 V 4.3040 8.9678 123.9827 62.9279 32.6554 174.8506 22 A 5.2360 9.2776 131.9287 50.1866 21.3197 174.7293 23 S 5.0897 9.4648 118.8644 56.8942 65.8577 173.4259 24 V 4.5563 8.6097 124.2385 61.0908 33.7111 174.1631 25 R 5.2547 8.6201 128.0623 53.5140 33.8910 172.5336 26 P 4.5739 0.0000 0.0000 62.0426 32.3488 173.4239 27 G 4.5796 8.7221 115.6256 46.8738 0.0000 174.2132 28 K 4.7240 9.1346 122.1641 54.8940 33.4451 175.9984 29 G 4.1305 8.4753 104.3616 46.1150 0.0000 173.7935 30 L 4.7212 7.4610 118.2906 53.3159 45.0287 177.8307 31 L 4.9972 8.3764 121.4181 53.0361 44.8341 174.5875 32 K 4.8693 8.7712 125.9791 54.5470 34.2275 175.2225 33 V 4.3401 8.3746 126.6723 61.5381 34.0499 174.7032 34 N 4.1496 10.8467 126.2816 54.1342 38.3861 174.4103 35 G 3.9219 9.0420 102.3359 45.5227 0.0000 172.8041 36 S 4.5195 7.4001 112.6329 57.1151 67.2009 173.5040 37 P 5.1843 0.0000 0.0000 61.2468 32.4655 177.1051 38 I 3.5121 8.4760 122.1951 64.8395 37.0850 177.2358 39 D 4.6777 8.1264 116.9951 55.7997 41.0200 176.4878 40 M 4.6244 8.0209 116.4414 55.3767 32.6006 175.9790 41 I 3.8822 7.5922 120.2198 61.3370 37.8526 175.9021 42 N 4.3578 8.7642 120.5177 56.4854 39.1130 174.7622 43 P 4.5184 0.0000 0.0000 60.5824 29.5491 176.5350 44 Q 3.9286 8.4224 122.3132 59.2028 28.6598 180.0323 45 I 3.6484 7.4909 120.3329 63.9342 36.9951 177.9381 46 L 4.0654 7.8651 119.8036 57.3307 41.1697 179.2754 47 Q 3.9909 7.5527 118.9449 59.1935 28.6812 179.0441 48 A 4.1198 7.9674 121.0009 55.3325 18.2663 179.4690 49 K 3.7842 8.1190 117.0092 59.9858 31.9397 179.4492 50 I 3.6247 7.3061 117.9012 64.4326 37.2471 177.1679 51 Y 4.0770 8.1902 117.3424 59.8720 38.4281 177.4670 52 E 3.8597 7.9907 120.6327 59.0633 29.3799 177.5305 53 P 4.1298 0.0000 0.0000 65.5579 31.4157 178.3132 54 I 3.6910 7.7327 118.0411 64.6373 36.7895 178.2193 55 L 3.9185 7.9702 118.3162 57.8958 41.6689 179.0652 56 L 3.8623 7.8551 119.0257 57.6260 41.7830 178.1085 57 L 4.4638 7.5302 117.3148 56.0264 43.4696 176.2459 58 G 4.0906 8.0726 106.5618 44.0046 0.0000 174.8619 59 Q 4.7611 9.2311 122.9982 59.2594 28.3810 179.1187 60 Q 3.9106 8.1228 119.5383 59.1380 28.2977 178.7877 61 K 3.9498 7.9437 118.8427 59.4887 32.3312 179.4443 62 F 4.1637 8.1851 114.4019 59.9081 37.7747 177.3598 63 A 3.1777 7.2878 121.3263 54.3574 17.9712 178.9869 64 N 4.2136 7.7524 115.1458 54.6711 39.1039 174.4916 65 L 4.9421 6.7770 118.9900 52.8914 45.6260 175.5318 66 D 5.1965 9.1553 120.4355 53.0009 43.3146 175.5435 67 I 4.8052 8.6849 126.2724 59.4683 39.4004 175.0660 68 R 4.9306 8.9148 124.9082 54.4030 31.4998 175.2315 69 I 5.1863 9.2213 124.7966 59.5068 41.2940 174.6721 70 R 5.1498 9.2400 123.8129 54.4725 33.7298 174.6818 71 V 4.8912 8.3378 122.4007 59.8591 34.3636 175.5550 72 R 4.5834 8.3124 127.3780 53.8610 28.8345 174.6515 73 G 4.2765 8.0752 123.4116 45.3852 0.0000 171.5714 74 S 4.4217 8.1923 115.6450 57.3150 65.4979 174.7630 75 G 4.0751 7.4339 105.3927 41.7931 0.0000 173.1320 76 Y 4.2569 8.1921 118.7858 61.6419 37.6801 179.4980 77 T 4.0249 8.0723 114.0947 66.8839 68.9729 176.2836 78 S 4.4652 8.2075 116.3005 61.9031 62.9145 176.3728 79 Q 4.0254 8.2523 120.7193 59.3237 28.5498 179.4666 80 V 3.5400 7.5773 118.9153 66.5533 31.3920 177.6566 81 Y 3.8378 8.2175 115.9845 60.8062 37.6501 178.5473 82 A 4.0945 7.9283 121.3295 55.1773 18.4261 179.4887 83 I 3.8403 8.4694 118.6656 64.3823 37.0756 178.6506 84 R 3.8367 7.9957 119.7056 59.5118 30.0696 178.2826 85 Q 4.4023 8.6767 120.5437 58.3706 28.9162 178.5466 86 A 3.9328 8.5382 122.3207 55.0019 18.4743 179.1478 87 L 3.8714 7.4722 117.0908 58.3891 41.6317 179.9532 88 S 4.1288 7.9629 114.4103 61.7939 62.7914 177.1895 89 K 4.0705 8.1548 121.1688 59.1833 31.6528 179.8224 90 G 3.5390 8.7147 106.3772 47.9197 0.0000 175.7337 91 I 3.6636 8.1193 123.2358 64.1061 36.8743 178.7881 92 V 3.6681 7.4691 117.8282 65.9715 31.4890 177.6123 93 A 4.1427 8.5548 120.9554 55.1952 18.0921 178.9033 94 Y 3.7140 8.8194 118.5794 61.2991 39.0865 178.1014 95 H 4.3167 8.2960 116.4650 58.4836 28.4982 177.6037 96 A 4.1034 7.5092 122.2340 55.0068 18.4670 178.7400 97 K 4.1329 8.0267 114.2639 57.6870 32.8571 177.4293 98 Y 4.3304 8.0884 114.5610 57.4314 38.3277 174.9566 99 V 4.4371 7.2191 117.6030 61.7074 34.8530 173.0216 100 D 4.4898 8.6347 120.1118 54.0414 40.5982 177.2184 101 E 3.9572 9.0024 124.6921 59.1567 29.2799 178.5142 102 N 4.3977 8.1169 117.0444 56.6670 39.0288 176.7363 103 S 4.1424 8.4160 116.1687 61.0739 62.8452 176.5115 104 K 3.9411 8.0014 122.8029 59.5783 32.1976 178.6622 105 R 3.9126 7.6356 117.2663 59.3495 29.9518 178.6764 106 E 3.9422 7.9539 118.0537 59.7956 29.4679 179.6147 107 I 3.7437 7.5265 119.6820 64.0312 37.1273 178.3475 108 K 3.8962 8.3047 120.7525 59.8341 32.1034 178.7347 109 E 4.0931 8.1470 118.4270 59.1469 29.3790 178.9711 110 Q 3.9653 8.0481 119.7656 59.3793 29.0864 178.8498 111 L 4.1198 8.2703 119.7700 58.1842 41.5889 179.0385 112 M 3.9716 8.2044 117.6419 58.9594 32.0347 178.6421 113 Q 4.1572 8.3522 116.8391 59.0444 28.9468 178.1773 114 Y 4.1160 7.4372 117.9268 59.2407 39.4808 175.0514 115 D 4.6540 8.2406 116.7217 53.1407 44.7777 175.2170 116 R 4.2127 8.6345 124.5973 58.5554 30.6296 178.5946 117 S 4.4102 9.2971 109.7702 59.3393 62.6216 174.5869 118 L 4.5702 7.8955 122.0351 55.4851 43.1495 177.6680 119 L 4.2920 7.8429 115.5407 56.0990 43.6304 176.8684 120 V 3.8019 7.8967 116.2393 62.5996 32.1205 174.3335 121 A 4.8323 8.0873 123.6894 49.8659 20.7950 175.8775 122 D 4.4475 8.7484 123.0142 53.4622 39.6722 173.9357 123 P 4.2939 0.0000 0.0000 65.4957 31.2816 177.2137 124 R 4.0305 7.7947 115.6003 55.9519 30.1230 176.3271 125 R 4.6065 8.0950 119.0682 55.9902 32.0864 174.4402 126 M 4.4022 8.4714 122.2010 55.1628 33.9235 175.3475 127 E 4.6329 8.2755 122.1739 53.0420 31.9183 173.8062 128 P 4.2918 0.0000 0.0000 62.5758 31.8020 176.5021 129 K 4.2733 8.2246 121.3167 56.7054 33.3235 175.6342 130 K 4.5854 8.0629 116.8002 55.1531 36.0895 176.9861 131 C 4.2362 8.9072 118.4353 59.9528 29.4643 174.9251 132 G 3.7353 8.0747 109.1661 47.7410 0.0000 173.6752 133 G 4.1323 7.5573 106.2593 46.4201 0.0000 173.3597 134 R 4.1469 8.8945 115.5668 58.2141 30.6221 176.2343 135 G 3.9450 7.5268 106.9019 44.4767 0.0000 172.5119 136 A 4.0351 8.7476 121.3028 55.1503 18.5387 179.1244 137 R 4.5983 7.6873 108.8486 56.1765 33.4869 175.0346 138 S 4.7109 7.8125 114.9226 57.4797 64.5508 172.8665 139 K 4.5375 8.0119 119.4785 54.7196 35.9335 175.9011 140 M 3.9029 8.6044 119.7880 56.0252 32.3483 176.1601 141 Q 4.1811 8.4989 123.6163 56.6051 29.3186 177.5308 142 K 4.4319 8.1015 117.5658 54.9668 33.5985 175.0931 143 A 4.2419 8.4282 126.1898 52.1013 18.3558 175.4747 144 Y 4.1387 8.1813 120.5804 54.7570 40.5059 176.1730 145 R 4.1693 8.1598 125.5041 57.0983 30.4296 176.3600 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 3 Q 8.34 4.36 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.61 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 4 Q 7.57 4.31 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.81 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 5 K 8.28 5.42 0.00 1.94 1.90 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.17 1.18 7.81 6 P 0.00 4.33 0.00 2.22 2.16 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 7 Q 8.31 4.55 0.00 2.17 2.16 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 2.40 2.85 0.00 8 L 7.60 5.04 0.00 1.61 1.47 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.30 4.43 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 0.91 0.00 0.00 0.42 0.00 0.00 10 Q 8.79 5.01 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 11 T 8.98 4.84 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 1.21 0.00 0.00 12 F 7.71 6.18 0.00 2.93 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 13 G 8.77 4.45 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 0.00 0.00 0.00 14 R 8.49 5.75 0.00 1.92 1.85 0.00 3.10 0.00 0.00 3.79 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 15 K 8.88 4.17 0.00 1.84 1.67 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.36 1.28 7.81 16 K 9.50 4.02 0.00 1.97 2.00 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.45 7.81 17 N 8.13 4.60 0.00 2.90 3.13 0.00 0.00 7.20 7.35 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 18 A 8.85 4.12 1.37 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 0.00 0.00 19 V 8.55 4.73 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 0.98 0.00 0.00 0.90 0.00 0.00 20 A 9.60 4.78 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.97 4.30 2.19 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 0.83 0.00 0.00 0.95 0.00 0.00 22 A 9.28 5.24 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 23 S 9.46 5.09 0.00 3.85 3.99 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 24 V 8.61 4.56 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 0.95 0.00 0.00 25 R 8.62 5.25 0.00 1.91 1.70 0.00 3.16 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 26 P 0.00 4.57 0.00 2.15 2.13 0.00 4.00 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.36 0.00 27 G 8.72 4.58 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 28 K 9.13 4.72 0.00 1.73 1.80 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.30 7.81 29 G 8.48 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 0.00 0.00 0.00 0.00 30 L 7.46 4.72 0.00 1.61 1.59 0.92 0.55 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 31 L 8.38 5.00 0.00 1.47 1.45 0.68 0.54 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 32 K 8.77 4.87 0.00 1.83 1.64 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.39 7.81 33 V 8.37 4.34 2.06 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 0.86 0.00 0.00 0.87 0.00 0.00 34 N 10.85 4.15 0.00 2.76 2.87 0.00 0.00 7.49 7.86 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 35 G 9.04 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 0.00 0.00 0.00 36 S 7.40 4.52 0.00 3.84 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 37 P 0.00 5.18 0.00 2.23 2.17 0.00 3.91 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 38 I 8.48 3.51 1.79 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.72 0.66 0.00 0.00 39 D 8.13 4.68 0.00 2.69 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.02 4.62 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 41 I 7.59 3.88 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.95 0.00 0.00 42 N 8.76 4.36 0.00 2.86 2.93 0.00 0.00 7.04 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 43 P 0.00 4.52 0.00 2.22 1.95 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.96 0.00 44 Q 8.42 3.93 0.00 2.21 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.49 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 45 I 7.49 3.65 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.10 0.91 0.00 0.00 46 L 7.87 4.07 0.00 1.68 1.67 0.96 1.02 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 47 Q 7.55 3.99 0.00 2.45 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 48 A 7.97 4.12 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 49 K 8.12 3.78 0.00 1.90 1.69 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.47 7.81 50 I 7.31 3.62 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.36 0.62 0.00 0.00 51 Y 8.19 4.08 0.00 3.14 2.92 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 52 E 7.99 3.86 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 2.38 2.57 0.00 53 P 0.00 4.13 0.00 2.09 2.06 0.00 3.69 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 54 I 7.73 3.69 2.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.43 0.70 0.00 0.00 55 L 7.97 3.92 0.00 1.51 1.68 0.87 0.90 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 56 L 7.86 3.86 0.00 1.29 1.79 0.81 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.53 4.46 0.00 1.60 1.69 0.92 0.93 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 58 G 8.07 4.09 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 0.00 0.00 0.00 59 Q 9.23 4.76 0.00 2.16 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 60 Q 8.12 3.91 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 61 K 7.94 3.95 0.00 1.79 1.89 0.00 1.70 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.75 1.47 7.81 62 F 8.19 4.16 0.00 3.19 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.29 3.18 0.90 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 0.00 0.00 0.00 0.00 0.00 64 N 7.75 4.21 0.00 2.74 2.67 0.00 0.00 6.96 6.33 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 65 L 6.78 4.94 0.00 1.27 1.46 -0.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 66 D 9.16 5.20 0.00 2.49 2.57 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 0.00 67 I 8.68 4.81 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.80 0.88 0.00 0.00 68 R 8.91 4.93 0.00 1.85 2.03 0.00 2.71 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 69 I 9.22 5.19 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 0.94 0.00 0.00 70 R 9.24 5.15 0.00 1.66 1.78 0.00 3.07 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 71 V 8.34 4.89 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 1.22 0.00 0.00 0.95 0.00 0.00 72 R 8.31 4.58 0.00 1.78 1.75 0.00 3.26 0.00 0.00 3.21 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 73 G 8.08 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 0.00 0.00 0.00 0.00 74 S 8.19 4.42 0.00 3.94 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 75 G 7.43 4.08 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 0.00 0.00 0.00 76 Y 8.19 4.26 0.00 3.03 3.04 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 0.00 0.00 0.00 77 T 8.07 4.02 4.38 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 1.46 0.00 0.00 78 S 8.21 4.47 0.00 4.01 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 0.00 79 Q 8.25 4.03 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 80 V 7.58 3.54 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 0.92 0.00 0.00 1.01 0.00 0.00 81 Y 8.22 3.84 0.00 3.32 3.06 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 82 A 7.93 4.09 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 0.00 0.00 0.00 0.00 0.00 83 I 8.47 3.84 1.94 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 1.41 1.13 0.86 0.00 0.00 84 R 8.00 3.84 0.00 1.95 2.10 0.00 2.88 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 85 Q 8.68 4.40 0.00 2.33 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 86 A 8.54 3.93 1.37 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 0.00 0.00 87 L 7.47 3.87 0.00 1.90 1.70 0.78 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.96 4.13 0.00 4.10 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 89 K 8.15 4.07 0.00 1.94 1.72 0.00 1.59 0.00 0.00 1.22 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.64 7.81 90 G 8.71 3.54 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 0.00 91 I 8.12 3.66 1.89 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 1.39 0.81 0.97 0.00 0.00 92 V 7.47 3.67 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 0.83 0.00 0.00 1.07 0.00 0.00 93 A 8.55 4.14 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 94 Y 8.82 3.71 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.30 4.32 0.00 3.44 3.42 0.00 5.67 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 96 A 7.51 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.03 4.13 0.00 1.94 1.71 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.47 7.81 98 Y 8.09 4.33 0.00 2.26 2.73 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 99 V 7.22 4.44 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 0.86 0.00 0.00 1.10 0.00 0.00 100 D 8.63 4.49 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 9.00 3.96 0.00 2.08 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 2.39 2.46 0.00 102 N 8.12 4.40 0.00 2.84 2.80 0.00 0.00 6.98 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.42 4.14 0.00 4.01 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 0.00 104 K 8.00 3.94 0.00 1.90 2.09 0.00 1.76 0.00 0.00 2.18 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.56 7.81 105 R 7.64 3.91 0.00 2.04 2.13 0.00 3.36 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 106 E 7.95 3.94 0.00 2.08 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 2.58 2.50 0.00 107 I 7.53 3.74 1.86 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.83 0.91 0.00 0.00 108 K 8.30 3.90 0.00 1.98 1.92 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 109 E 8.15 4.09 0.00 2.10 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 2.34 2.41 0.00 110 Q 8.05 3.97 0.00 2.35 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 111 L 8.27 4.12 0.00 1.88 1.74 0.93 1.08 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 0.00 112 M 8.20 3.97 0.00 1.95 2.36 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.86 0.00 113 Q 8.35 4.16 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 114 Y 7.44 4.12 0.00 3.05 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 0.00 115 D 8.24 4.65 0.00 2.69 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 0.00 116 R 8.63 4.21 0.00 1.93 1.97 0.00 3.19 0.00 0.00 3.40 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 117 S 9.30 4.41 0.00 4.09 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 7.90 4.57 0.00 1.76 1.76 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.84 4.29 0.00 1.60 1.65 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.90 3.80 2.17 0.00 0.00 0.00 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 1.00 0.00 0.00 121 A 8.09 4.83 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 0.00 122 D 8.75 4.45 0.00 2.59 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.29 0.00 2.21 2.20 0.00 3.84 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 124 R 7.79 4.03 0.00 1.92 2.00 0.00 2.94 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 125 R 8.09 4.61 0.00 1.76 1.77 0.00 3.35 0.00 0.00 3.14 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 126 M 8.47 4.40 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.57 0.00 127 E 8.28 4.63 0.00 1.91 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 2.16 2.19 0.00 128 P 0.00 4.29 0.00 2.21 2.04 0.00 3.82 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 129 K 8.22 4.27 0.00 1.74 1.80 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.44 7.81 130 K 8.06 4.59 0.00 1.95 1.63 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.36 1.37 7.81 131 C 8.91 4.24 0.00 3.07 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 0.00 132 G 8.07 3.74 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 0.00 0.00 0.00 133 G 7.56 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 0.00 0.00 0.00 0.00 134 R 8.89 4.15 0.00 1.94 2.08 0.00 2.99 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 135 G 7.53 3.94 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 0.00 0.00 0.00 136 A 8.75 4.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 7.69 4.60 0.00 1.75 1.89 0.00 3.20 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 138 S 7.81 4.71 0.00 3.88 3.78 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 0.00 139 K 8.01 4.54 0.00 1.70 1.75 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.43 7.81 140 M 8.60 3.90 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 141 Q 8.50 4.18 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 142 K 8.10 4.43 0.00 1.89 2.11 0.00 1.91 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.65 7.81 143 A 8.43 4.24 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 0.00 144 Y 8.18 4.14 0.00 2.88 2.89 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 0.00 145 R 8.16 4.17 0.00 1.93 1.90 0.00 3.37 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00