NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3748 8.2893 120.3493 55.5066 32.0856 173.9846 2 N 4.4753 8.0602 121.1651 50.4686 37.9462 171.4021 3 E 3.9705 9.3547 125.3654 56.9057 29.3009 178.3927 4 L 4.4227 8.1504 124.6794 53.3498 40.6861 176.0055 5 E 4.5343 8.0306 123.3132 53.5572 32.1457 175.7891 6 G 3.7899 8.1433 112.4290 45.2188 0.0000 172.2482 7 Y 4.7546 8.9273 117.3298 56.0908 40.1126 176.8596 8 V 4.0831 8.5690 123.6466 63.3763 32.5488 177.5166 9 T 4.2204 8.1565 117.2861 66.0563 68.8829 175.0028 10 K 4.3983 7.9467 120.1808 56.5648 32.4798 177.1544 11 A 4.2840 8.1628 123.7216 53.4975 19.0970 182.1224 12 Q 3.4487 7.7514 111.7073 57.9819 31.6042 180.1322 13 S 4.1055 8.0219 110.8224 59.9484 63.1706 174.3028 14 F 4.2873 8.6838 119.9161 56.4751 39.9351 174.5124 15 R 4.5685 8.3569 121.7688 54.7114 32.1130 174.3723 16 F 5.6670 8.7051 123.0121 55.7959 43.9111 173.5078 17 A 4.7199 8.5418 120.5306 50.5462 22.5074 175.2274 18 I 4.8129 8.8705 122.8309 59.4768 40.3206 174.9899 19 V 4.5911 8.6775 125.5516 61.1897 34.3776 174.6226 20 V 5.3092 8.8786 120.5878 58.3505 35.3294 174.6416 21 A 5.6790 8.4429 125.4540 50.7467 19.5569 177.6943 22 R 4.3448 8.9510 121.8153 59.0656 31.5645 176.4315 23 F 4.0374 8.4671 121.4011 59.1782 40.1327 174.8942 24 N 4.3321 8.5089 121.4697 54.4018 36.3465 176.0456 25 E 4.4960 8.0257 121.6165 59.3303 29.3907 177.6687 26 F 4.0164 8.3524 118.6897 60.9916 39.4433 176.4282 27 V 4.1176 8.5103 117.1714 65.0574 32.0734 177.5292 28 T 3.8571 8.0175 109.0937 65.1417 68.2643 175.3039 29 R 4.0492 8.4342 122.1624 59.3037 29.9824 178.1528 30 R 3.8121 7.9682 116.7453 59.2880 30.1407 178.1977 31 L 3.8381 8.2548 120.2390 58.6353 41.9862 178.7159 32 M 3.8707 8.5562 117.7685 58.8243 32.2099 177.6397 33 E 4.0791 8.7305 119.1229 59.6347 29.5724 179.9131 34 G 3.4806 8.4358 105.4487 47.7050 0.0000 175.3404 35 A 3.6697 7.8564 124.0299 54.7903 18.3535 178.8783 36 L 4.0684 8.3639 118.7537 58.6151 41.9728 178.2966 37 D 4.3928 8.6143 117.7738 58.1277 41.1054 178.7666 38 T 3.8633 7.9705 115.8776 66.9261 68.2001 176.0904 39 F 4.3061 7.6361 118.0365 60.7411 39.2440 177.4590 40 K 4.1865 8.1307 117.2492 59.6724 31.7575 179.0739 41 K 3.8240 8.6005 118.7171 59.2886 32.6058 176.8656 42 Y 4.2939 8.6746 117.5137 58.5056 38.5555 176.0681 43 S 3.7684 8.2281 111.2924 58.8371 63.4937 172.8212 44 V 3.9766 7.8126 120.2290 62.0966 31.7183 175.7956 45 N 4.7144 8.3178 120.6997 53.7131 40.4944 174.1137 46 E 4.5119 9.0269 126.3250 56.3949 30.6482 174.4754 47 D 4.2912 8.8279 114.0430 59.8754 40.1850 173.9237 48 I 3.4728 6.6138 109.5179 55.9218 39.4692 174.3540 49 D 4.6499 8.5059 123.9253 54.0198 42.1292 175.6005 50 V 4.6217 8.3560 116.3594 59.5631 34.0242 175.0361 51 V 4.2887 8.8608 126.6974 60.9526 33.3509 174.3904 52 W 5.2368 8.8516 128.0260 55.8436 30.3819 176.1649 53 V 4.7117 9.1436 117.8520 58.8834 34.8965 174.7975 54 P 4.3551 0.0000 0.0000 65.5242 31.9119 176.3842 55 G 4.5130 8.1641 108.3106 42.3819 0.0000 173.1341 56 A 3.9126 8.6633 122.9444 55.3790 18.3977 179.4365 57 Y 3.9460 8.3324 116.0370 61.1866 38.6407 178.1518 58 E 4.1357 8.6880 119.4207 59.4333 29.5255 179.3474 59 L 3.9709 7.7999 119.0887 58.7207 41.7541 179.0584 60 G 3.6598 7.8615 100.8147 49.3001 0.0000 175.5790 61 V 3.6558 7.7721 111.9360 63.9501 32.1746 178.5582 62 T 3.8363 7.7491 114.6781 66.6668 68.3002 176.2849 63 A 3.8851 8.6439 122.5750 55.6236 18.4253 179.3605 64 Q 3.8098 8.5186 118.1027 60.0691 29.2314 178.7280 65 A 4.0077 8.8547 122.0464 54.6349 18.0543 179.1038 66 L 4.1515 8.2052 117.9937 57.7944 42.3632 180.2292 67 G 3.8207 8.8568 105.5468 47.9834 0.0000 176.0525 68 K 4.1522 8.1088 120.2483 58.2676 32.3286 178.9537 69 S 4.3551 8.3578 114.1362 58.6485 62.6974 175.1060 70 G 3.9302 7.8975 109.4750 46.3103 0.0000 174.7426 71 K 3.8029 7.8342 119.3361 58.1423 32.2015 176.8868 72 Y 4.7836 7.3855 114.2346 56.5559 40.4002 174.9230 73 H 4.8248 9.0906 118.3887 57.5493 30.0236 175.7778 74 A 4.9576 7.8835 118.0446 50.7247 22.6826 175.0918 75 I 4.8948 8.8300 115.5925 58.9361 40.7123 174.6530 76 V 4.6176 8.8056 125.8189 60.1204 33.8232 174.1466 77 C 5.1106 9.0612 123.0714 57.8806 30.6348 172.8082 78 L 5.5293 8.1374 123.5876 52.1045 44.9128 175.8071 79 G 4.3289 8.0702 107.3445 46.3499 0.0000 171.9348 80 A 5.1918 8.5515 121.4526 50.5628 22.1365 176.2613 81 V 4.2757 9.1827 123.2643 59.9297 33.5867 175.2255 82 V 4.2893 8.4596 119.4779 60.5637 32.6060 177.7617 83 K 3.5674 8.4968 127.3037 56.7266 28.9614 176.9511 84 G 3.7852 8.5308 113.0851 47.2936 0.0000 171.5600 85 D 4.6203 7.8338 116.9400 54.5960 43.2679 177.7812 86 T 4.2714 8.4885 115.4426 61.3406 70.7874 176.0422 87 S 5.0260 8.5467 116.8666 60.2450 62.6311 175.2400 88 H 3.8912 7.9332 122.5043 60.1084 29.4344 175.3196 89 Y 4.1685 8.1770 120.4875 61.3791 38.4554 177.7222 90 D 4.1920 8.4647 118.2182 57.9200 41.0988 178.6459 91 A 3.8626 8.2652 120.3787 55.8587 18.2846 179.4977 92 V 3.6122 8.3274 115.8330 66.0516 31.6086 178.2365 93 V 3.4694 8.0609 117.9920 66.3984 31.1722 177.8008 94 N 4.2381 8.7921 116.2024 56.3690 38.3670 177.2436 95 S 3.9763 8.0946 116.0744 62.0393 62.9543 176.3932 96 A 3.9359 8.5954 123.7749 55.3572 18.0308 179.1479 97 S 4.2370 8.6938 110.5490 61.7600 62.5141 176.4904 98 S 4.1162 8.8159 116.4158 61.6230 62.0800 176.1185 99 G 3.6460 8.5248 108.4727 48.2089 0.0000 175.3470 100 V 3.6682 7.9108 121.1241 65.8895 31.4715 177.3697 101 L 3.9503 8.1757 119.9792 57.5160 41.7846 178.7436 102 S 4.0852 8.8276 114.7904 62.0343 63.0281 176.5296 103 A 4.1294 8.6419 123.2508 55.3962 17.9549 179.5079 104 G 4.3205 8.2852 103.0066 47.8323 0.0000 175.4777 105 L 4.0297 7.7914 120.0508 57.5849 41.8029 179.0528 106 N 4.5073 8.6561 115.6823 56.4438 38.6351 177.4050 107 S 4.3858 8.7874 114.5153 58.9858 63.3556 175.3673 108 G 3.9774 8.1711 109.6154 45.6754 0.0000 172.8495 109 V 4.5583 7.8173 120.0771 59.8403 34.3716 173.2091 110 P 4.5603 0.0000 0.0000 63.2648 32.3153 174.7724 111 C 5.2252 8.5972 122.2935 57.8223 30.6271 173.7796 112 V 3.7582 8.8260 125.9255 62.4759 32.3179 175.3777 113 F 4.1435 9.0021 131.6167 56.4742 37.8986 175.5241 114 G 4.1806 8.7435 118.7182 44.1398 0.0000 170.7490 115 V 4.8212 6.3865 116.9638 59.5681 34.4099 177.2850 116 L 4.4152 8.8899 125.8493 54.2040 42.9143 177.2086 117 T 5.3491 7.9582 112.5281 60.4137 68.3179 173.2899 118 C 4.2796 8.2147 119.1577 60.5746 30.0840 174.4078 119 D 4.5168 9.0108 120.1332 55.9744 39.5585 176.7178 120 N 4.7254 9.5198 116.2618 51.9062 39.4646 175.8238 121 M 3.9698 8.8318 119.6403 59.2010 32.1661 177.7928 122 D 4.3682 8.2236 117.2712 57.7899 41.0183 178.1344 123 Q 3.9926 8.7901 116.7594 59.0259 29.0478 178.6625 124 A 4.1619 7.7228 120.5448 55.5266 18.5567 179.4393 125 I 3.7502 8.0571 118.2147 65.1705 37.2298 178.2901 126 N 4.4442 8.1490 116.7394 56.1861 38.3958 177.4968 127 R 4.0547 8.7021 119.0997 57.5018 30.8857 176.8100 128 A 4.4637 7.6374 123.2175 51.4697 18.3072 177.5023 129 G 3.9181 9.0103 106.0172 45.8592 0.0000 174.0045 130 G 4.2214 7.8065 111.0812 44.1246 0.0000 175.4709 131 K 4.1496 8.2930 120.3685 58.1674 32.6102 177.2842 132 A 4.4728 7.9942 121.5477 51.8069 20.0674 178.4845 133 G 3.7345 8.7637 104.8806 45.2701 0.0000 172.9704 134 N 5.7807 8.0545 119.2256 49.9984 41.4082 175.5295 135 K 4.1536 8.1683 131.2770 58.9813 32.3332 177.9504 136 G 3.7789 8.2395 104.9032 48.1210 0.0000 174.8260 137 A 3.7784 8.4115 123.3069 54.5649 17.9426 179.2815 138 E 3.7351 8.0008 116.7474 59.8566 29.2126 179.8310 139 S 4.0067 8.6027 115.0700 61.5525 62.8091 176.4871 140 A 3.3991 7.5111 123.0876 54.8336 17.9654 179.0171 141 L 3.3277 7.5133 118.5217 58.6941 42.0304 179.5132 142 T 3.6871 7.9952 115.3208 66.3895 68.2909 176.1199 143 A 3.8875 8.0333 123.0253 55.8126 18.2491 179.1287 144 I 3.6145 7.5466 117.7500 64.6996 37.1582 177.7442 145 E 3.8301 8.3390 119.3479 59.9305 29.4353 179.3819 146 M 3.8206 8.4614 118.2381 58.4678 31.7991 178.0834 147 A 3.8613 7.9220 119.6186 55.3836 18.7413 178.8968 148 S 4.2456 8.0011 110.6766 61.5933 62.3922 176.3102 149 L 3.9963 8.4406 122.9229 58.6332 41.7914 179.0262 150 F 4.4578 8.8096 117.4911 59.2383 39.8572 174.7689 151 E 5.1740 7.8858 118.2716 52.8155 28.6982 173.8632 152 H 4.8907 7.8293 129.3301 56.8442 32.2771 174.6343 153 H 4.4813 8.9689 113.6630 57.2052 29.0793 174.9740 154 L 4.0069 7.3431 121.0074 53.2304 41.9084 173.9673 155 K 4.1259 7.5306 120.7668 56.8058 32.7071 175.9270 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 1 M 8.29 4.37 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 N 8.06 4.48 0.00 2.91 2.79 0.00 0.00 6.33 6.77 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 3 E 9.35 3.97 0.00 1.97 1.97 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 2.31 2.33 0.00 4 L 8.15 4.42 0.00 1.68 1.83 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.03 4.53 0.00 1.79 1.58 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 2.03 2.17 0.00 6 G 8.14 3.79 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 0.00 0.00 0.00 7 Y 8.93 4.75 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.57 4.08 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 0.96 0.00 0.00 0.88 0.00 0.00 9 T 8.16 4.22 4.31 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 1.25 0.00 0.00 10 K 7.95 4.40 0.00 1.95 1.88 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.35 0.00 0.00 3.59 0.00 0.00 0.00 0.00 1.61 1.84 7.81 11 A 8.16 4.28 1.57 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 0.00 0.00 12 Q 7.75 3.45 0.00 2.32 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 13 S 8.02 4.11 0.00 3.63 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 14 F 8.68 4.29 0.00 2.62 2.31 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 15 R 8.36 4.57 0.00 1.83 1.64 0.00 3.11 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.77 0.00 16 F 8.71 5.67 0.00 2.49 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.54 4.72 0.17 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 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.87 4.81 1.74 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 1.17 0.87 0.74 0.00 0.00 19 V 8.68 4.59 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 0.92 0.00 0.00 0.87 0.00 0.00 20 V 8.88 5.31 1.73 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 0.63 0.00 0.00 -0.60 0.00 0.00 21 A 8.44 5.68 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 22 R 8.95 4.34 0.00 2.04 2.14 0.00 3.13 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.39 0.00 23 F 8.47 4.04 0.00 3.35 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 24 N 8.51 4.33 0.00 3.25 3.07 0.00 0.00 6.72 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.03 4.50 0.00 2.30 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 2.36 2.28 0.00 26 F 8.35 4.02 0.00 3.11 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 27 V 8.51 4.12 2.29 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 1.02 0.00 0.00 1.15 0.00 0.00 28 T 8.02 3.86 4.35 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 1.33 0.00 0.00 29 R 8.43 4.05 0.00 2.16 1.99 0.00 3.36 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.93 0.00 30 R 7.97 3.81 0.00 2.07 1.93 0.00 3.25 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 31 L 8.25 3.84 0.00 1.88 1.72 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 M 8.56 3.87 0.00 2.10 1.81 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.60 0.00 33 E 8.73 4.08 0.00 2.16 2.01 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 2.36 2.60 0.00 34 G 8.44 3.48 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 0.00 0.00 0.00 35 A 7.86 3.67 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 36 L 8.36 4.07 0.00 1.99 1.72 1.01 1.19 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 37 D 8.61 4.39 0.00 2.78 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.97 3.86 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 0.77 0.00 0.00 39 F 7.64 4.31 0.00 3.34 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 40 K 8.13 4.19 0.00 1.97 1.94 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.67 7.81 41 K 8.60 3.82 0.00 2.07 2.30 0.00 1.96 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.50 7.81 42 Y 8.67 4.29 0.00 3.32 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 43 S 8.23 3.77 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 44 V 7.81 3.98 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 0.90 0.00 0.00 1.32 0.00 0.00 45 N 8.32 4.71 0.00 2.76 2.75 0.00 0.00 6.94 7.53 0.00 0.00 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 E 9.03 4.51 0.00 2.05 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 2.14 2.24 0.00 47 D 8.83 4.29 0.00 2.78 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 48 I 6.61 3.47 1.71 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 1.38 0.86 0.54 0.00 0.00 49 D 8.51 4.65 0.00 2.63 2.65 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 50 V 8.36 4.62 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 0.60 0.00 0.00 0.91 0.00 0.00 51 V 8.86 4.29 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 0.97 0.00 0.00 0.85 0.00 0.00 52 W 8.85 5.24 0.00 3.23 3.09 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 53 V 9.14 4.71 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 0.81 0.00 0.00 1.06 0.00 0.00 54 P 0.00 4.36 0.00 2.20 2.38 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 55 G 8.16 4.51 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 0.00 56 A 8.66 3.91 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 57 Y 8.33 3.95 0.00 3.00 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 58 E 8.69 4.14 0.00 2.39 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 2.42 2.50 0.00 59 L 7.80 3.97 0.00 1.76 1.69 0.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.86 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.77 3.66 2.11 0.00 0.00 0.00 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 1.02 0.00 0.00 62 T 7.75 3.84 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 1.21 0.00 0.00 63 A 8.64 3.89 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 64 Q 8.52 3.81 0.00 2.19 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 65 A 8.85 4.01 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 66 L 8.21 4.15 0.00 1.74 1.72 0.71 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.86 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.11 4.15 0.00 1.96 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.48 7.81 69 S 8.36 4.36 0.00 4.07 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 70 G 7.90 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 71 K 7.83 3.80 0.00 0.79 1.21 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.38 7.81 72 Y 7.39 4.78 0.00 2.93 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 73 H 9.09 4.82 0.00 2.84 3.46 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.88 4.96 1.43 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 0.00 0.00 0.00 75 I 8.83 4.89 1.79 0.00 0.00 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 1.28 1.50 0.77 0.00 0.00 76 V 8.81 4.62 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 0.99 0.00 0.00 0.83 0.00 0.00 77 C 9.06 5.11 0.00 2.69 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 78 L 8.14 5.53 0.00 1.40 1.40 0.79 0.87 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 79 G 8.07 4.33 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 0.00 80 A 8.55 5.19 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 81 V 9.18 4.28 1.96 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 0.83 0.00 0.00 0.87 0.00 0.00 82 V 8.46 4.29 2.32 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 0.76 0.00 0.00 1.06 0.00 0.00 83 K 8.50 3.57 0.00 0.79 1.32 0.00 0.86 0.00 0.00 1.52 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.08 0.64 7.81 84 G 8.53 3.79 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 0.00 0.00 0.00 85 D 7.83 4.62 0.00 2.63 2.41 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 86 T 8.49 4.27 4.29 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 1.24 0.00 0.00 87 S 8.55 5.03 0.00 4.28 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 0.00 88 H 7.93 3.89 0.00 3.28 3.43 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 8.18 4.17 0.00 3.11 3.09 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 90 D 8.46 4.19 0.00 2.90 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 91 A 8.27 3.86 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 92 V 8.33 3.61 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 0.94 0.00 0.00 0.99 0.00 0.00 93 V 8.06 3.47 1.90 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 0.91 0.00 0.00 0.15 0.00 0.00 94 N 8.79 4.24 0.00 2.84 2.79 0.00 0.00 7.06 7.55 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 95 S 8.09 3.98 0.00 3.70 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 96 A 8.60 3.94 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 97 S 8.69 4.24 0.00 3.72 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 98 S 8.82 4.12 0.00 3.80 3.97 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 99 G 8.52 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 0.00 100 V 7.91 3.67 2.46 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 1.10 0.00 0.00 0.97 0.00 0.00 101 L 8.18 3.95 0.00 1.85 1.71 0.88 0.79 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 0.00 102 S 8.83 4.09 0.00 3.98 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 0.00 103 A 8.64 4.13 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 0.00 104 G 8.29 4.32 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 0.00 0.00 0.00 105 L 7.79 4.03 0.00 1.82 1.76 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.66 4.51 0.00 2.71 2.90 0.00 0.00 7.19 8.08 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 0.00 107 S 8.79 4.39 0.00 4.03 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 0.00 108 G 8.17 3.98 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 0.00 0.00 0.00 109 V 7.82 4.56 2.15 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 1.09 0.00 0.00 1.12 0.00 0.00 110 P 0.00 4.56 0.00 1.95 1.74 0.00 3.72 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 1.33 1.39 0.00 111 C 8.60 5.23 0.00 2.95 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 0.00 112 V 8.83 3.76 2.03 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 0.89 0.00 0.00 0.91 0.00 0.00 113 F 9.00 4.14 0.00 3.06 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 0.00 114 G 8.74 4.18 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 0.00 115 V 6.39 4.82 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 -0.88 0.00 0.00 0.74 0.00 0.00 116 L 8.89 4.42 0.00 1.63 1.66 0.95 0.30 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 0.00 117 T 7.96 5.35 4.31 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 1.27 0.00 0.00 118 C 8.21 4.28 0.00 2.97 3.09 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 0.00 119 D 9.01 4.52 0.00 2.67 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 N 9.52 4.73 0.00 2.88 2.91 0.00 0.00 6.77 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 M 8.83 3.97 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 122 D 8.22 4.37 0.00 2.74 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 0.00 123 Q 8.79 3.99 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 124 A 7.72 4.16 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 125 I 8.06 3.75 2.05 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.21 1.02 0.00 0.00 126 N 8.15 4.44 0.00 3.01 2.88 0.00 0.00 7.05 7.61 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 0.00 127 R 8.70 4.05 0.00 1.91 1.98 0.00 3.28 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 128 A 7.64 4.46 1.32 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 0.00 0.00 129 G 9.01 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 0.00 130 G 7.81 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 0.00 0.00 0.00 131 K 8.29 4.15 0.00 1.83 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.39 7.81 132 A 7.99 4.47 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 0.00 133 G 8.76 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 0.00 134 N 8.05 5.78 0.00 2.72 2.60 0.00 0.00 6.78 6.41 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 0.00 135 K 8.17 4.15 0.00 1.83 1.75 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.36 7.81 136 G 8.24 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 0.00 0.00 0.00 137 A 8.41 3.78 1.21 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 0.00 0.00 0.00 138 E 8.00 3.74 0.00 2.12 1.94 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 2.26 2.42 0.00 139 S 8.60 4.01 0.00 3.83 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 0.00 140 A 7.51 3.40 0.35 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 0.00 0.00 141 L 7.51 3.33 0.00 1.42 1.64 0.70 0.28 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 0.00 142 T 8.00 3.69 4.29 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 1.12 0.00 0.00 143 A 8.03 3.89 1.20 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 0.00 144 I 7.55 3.61 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.92 0.00 0.00 145 E 8.34 3.83 0.00 1.94 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 2.24 2.31 0.00 146 M 8.46 3.82 0.00 1.65 2.06 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.70 0.00 147 A 7.92 3.86 1.15 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 0.00 0.00 148 S 8.00 4.25 0.00 3.84 4.04 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 0.00 149 L 8.44 4.00 0.00 1.85 2.02 0.96 1.16 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 0.00 150 F 8.81 4.46 0.00 3.42 3.14 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 0.00 151 E 7.89 5.17 0.00 2.25 2.05 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 2.40 2.37 0.00 152 H 7.83 4.89 0.00 3.38 3.69 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.97 4.48 0.00 3.33 3.72 0.00 5.96 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.34 4.01 0.00 1.75 1.63 0.85 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.53 4.13 0.00 1.82 1.69 0.00 1.53 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.51 7.81