NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9347 8.3393 109.7315 45.7193 0.0000 172.4387 2 S 4.5058 7.8762 112.0056 56.2141 65.7396 172.7149 3 F 4.3367 9.5595 121.8594 56.6962 40.9592 177.3953 4 L 4.5667 8.2180 124.6581 52.2389 41.3851 175.2332 5 P 4.2814 0.0000 0.0000 65.7719 31.2845 178.6213 6 N 4.5344 8.1346 114.4810 54.8748 38.6190 175.5254 7 S 4.5266 7.8853 111.7826 58.0120 63.8176 174.2372 8 E 4.1423 7.8437 123.0367 56.5735 29.9273 175.8929 9 Q 4.5634 8.3078 123.0323 54.2530 32.9120 173.8715 10 Q 4.6156 8.5657 122.2290 54.0937 30.9077 174.6252 11 K 4.6655 8.4366 124.7980 54.6245 35.2209 175.2965 12 S 4.7862 8.4957 120.3887 56.9690 66.4555 173.5603 13 V 4.5554 8.0198 115.4537 60.0554 35.6616 173.9899 14 D 4.9082 8.4538 120.7897 52.8852 42.3550 176.2541 15 I 4.4086 8.1855 123.6982 59.3843 39.3410 175.2046 16 V 4.3606 7.9377 123.2246 60.9458 33.7291 174.4545 17 F 4.5838 8.8021 125.7994 56.0105 40.2140 174.6513 18 S 4.5220 8.2379 118.3574 58.1484 64.8999 174.0760 19 S 4.5724 8.4084 117.1039 57.3852 62.8095 172.3038 20 P 4.2487 0.0000 0.0000 63.4216 30.3242 174.4020 21 Q 4.3513 8.5931 122.0908 55.7648 31.7806 176.2126 22 D 4.9427 7.9331 117.4187 52.1451 43.2594 174.3764 23 L 4.9434 8.0389 117.3733 53.8747 45.8627 175.3128 24 T 4.7552 9.1314 110.8401 60.0924 71.9774 173.1685 25 V 4.8996 8.0688 121.0898 61.7468 35.2024 174.6310 26 S 4.6700 8.9832 121.1491 57.2249 67.9099 173.0172 27 L 5.0059 8.5756 125.5001 53.5079 44.5432 175.5189 28 I 4.4649 8.8228 128.6836 58.7077 39.3453 173.7335 29 P 4.7877 0.0000 0.0000 62.4969 31.9399 176.6864 30 V 3.9748 8.4449 124.9397 62.6040 32.0702 176.1369 31 S 4.3301 8.6810 121.9895 59.1594 63.9581 174.0918 32 G 3.8911 8.7838 109.1943 46.0754 0.0000 173.6340 33 L 4.1466 7.8350 119.1907 54.2341 42.1809 176.6059 34 K 4.5559 8.2882 121.7134 54.0073 34.8239 176.0666 35 A 4.1970 8.3847 125.7852 52.8206 19.3544 177.4298 36 G 3.8324 8.9718 105.1134 43.5680 0.0000 172.0287 37 K 4.3977 8.4097 121.2134 56.8526 32.4157 177.5242 38 N 5.0513 8.8813 125.2535 51.2151 40.9652 174.9121 39 A 4.2030 8.3295 122.1056 51.3346 19.8545 175.3562 40 P 4.1891 0.0000 0.0000 63.3213 32.2085 176.4879 41 S 4.1123 9.0532 117.1153 58.2496 60.6056 172.1759 42 A 4.0836 7.4734 121.8798 52.3186 19.1061 178.2015 43 K 4.5674 8.6681 122.3928 56.4716 32.4626 176.9852 44 I 4.5910 9.0558 116.4012 60.8418 40.2112 174.8618 45 A 5.0493 7.7616 122.5104 50.6484 22.8547 174.6307 46 K 4.8319 9.1292 121.9793 54.5357 34.8988 174.5682 47 L 4.9932 8.9308 130.1596 53.6629 43.9671 174.9552 48 V 4.6662 9.0955 126.5192 61.0176 34.1514 174.2586 49 V 4.5821 8.0815 126.6846 61.0740 34.2435 173.8928 50 N 5.2433 9.0256 125.1673 51.7231 42.2599 173.3539 51 S 4.7277 8.6320 114.4454 58.9510 66.0002 175.5887 52 T 4.3711 8.1560 112.3219 63.8077 70.3616 176.8849 53 T 4.1534 7.6938 108.6614 61.2441 68.3332 173.1412 54 L 5.0197 7.5169 121.0706 53.9487 45.6516 174.8013 55 K 4.5030 7.9442 116.2112 58.1717 35.1947 176.6860 56 E 4.5392 8.1646 127.6344 56.3807 30.0557 175.0000 57 F 5.0685 9.7451 122.0987 56.0463 39.9044 175.4418 58 G 4.6708 9.8431 111.3597 45.4897 0.0000 172.9112 59 V 5.6440 8.7455 120.5962 60.2549 34.8226 174.7511 60 R 4.6614 9.2196 121.5243 54.1982 34.3865 174.9487 61 G 2.0000 8.4709 110.4434 45.3963 0.0000 173.0352 62 I 4.4167 7.3627 123.6301 59.3861 39.6076 175.2418 63 S 4.4725 7.9842 120.9230 58.1492 64.8479 173.6679 64 N 4.6806 8.7365 117.1079 54.3362 38.7150 175.8595 65 N 4.8515 8.0950 117.4051 52.8631 40.4348 171.7629 66 V 4.4068 7.9020 121.6408 61.5673 32.7864 176.0536 67 V 4.3818 8.5250 118.9754 61.0552 32.6717 174.6444 68 D 4.8991 7.5744 119.2382 51.3311 42.4439 176.1502 69 S 4.2991 8.6611 113.3845 60.1482 63.1925 174.7724 70 T 4.2599 7.9536 109.7320 60.5571 69.5498 174.4029 71 G 3.8332 8.0121 110.8422 47.2130 0.0000 174.7479 72 T 4.8600 8.2898 107.8955 61.2494 70.3732 173.6905 73 A 5.2763 8.1201 122.2885 50.6138 23.0579 175.3718 74 W 5.2144 8.7255 117.5929 56.0554 32.2267 173.1313 75 R 5.1379 9.0914 118.6625 54.5379 32.6003 176.0671 76 V 4.7762 8.7122 114.6204 59.5963 36.0021 174.2487 77 A 5.2343 8.6401 124.4776 50.0123 21.2822 177.0016 78 G 2.9835 9.1220 109.8940 45.8677 0.0000 174.9080 79 K 3.9843 8.7985 124.8069 59.3102 32.2381 178.2639 80 N 4.5990 8.6347 114.6836 54.3144 39.0414 176.0815 81 T 4.3013 8.2026 106.7221 60.4344 70.5762 175.6323 82 G 3.9376 8.1928 108.7625 45.1770 0.0000 173.7666 83 K 4.2684 7.8336 120.1180 56.4812 33.2106 175.9311 84 E 5.3252 8.7811 123.3921 55.1394 31.3553 175.4230 85 I 4.6207 8.7007 116.3003 58.9631 41.6169 174.3011 86 G 4.2296 8.7902 111.3046 45.4168 0.0000 173.2799 87 V 4.7414 8.6868 117.9599 59.0357 36.5937 174.7885 88 G 3.7311 7.2863 108.2440 45.8136 0.0000 172.1382 89 L 4.8199 8.5275 120.6149 54.4103 42.1468 178.3701 90 S 4.3345 8.8755 117.5247 58.0561 63.9994 175.5638 91 S 4.1358 8.6732 117.5631 61.8614 62.2684 176.7291 92 D 4.3598 8.0004 120.1010 57.5398 40.9769 178.4917 93 S 4.3319 8.1884 115.5183 61.6992 62.7245 176.7004 94 L 4.2507 8.3427 121.9430 58.0693 41.2141 179.5665 95 R 4.2219 7.9895 115.8348 57.8372 30.0121 177.8265 96 R 4.5850 7.6043 117.7707 55.1285 30.9809 176.5749 97 S 3.6671 7.1021 113.5332 58.2211 63.7434 173.9425 98 D 4.4460 8.5279 122.9512 57.1578 41.4921 175.9915 99 S 4.3151 8.2354 111.3531 57.8659 66.6096 173.2071 100 T 4.7817 8.2277 116.6562 61.5849 68.5767 173.5844 101 E 4.3226 9.4369 125.5091 54.5342 32.3296 175.2354 102 K 4.9793 8.0645 120.6777 53.5804 32.1554 173.1775 103 W 4.6722 9.3905 131.2910 57.8992 30.7740 175.6310 104 N 4.2859 10.0903 125.7818 54.4409 35.9582 174.4577 105 G 4.2290 8.9097 108.2377 45.8447 0.0000 175.3223 106 V 3.8621 8.5795 121.2222 62.4487 32.4109 175.6159 107 N 5.2401 8.7984 125.7286 53.3265 39.4879 174.5541 108 W 5.1768 9.8724 122.5186 55.2964 33.6926 174.2433 109 M 4.8202 8.9102 123.0210 54.9243 33.2829 175.2730 110 T 4.7145 8.6248 113.1761 60.0330 72.1909 173.1388 111 F 4.9182 8.6617 120.8016 55.3117 43.9193 173.2063 112 N 4.6048 9.7086 120.2406 53.8155 39.5536 174.6524 113 S 4.4175 9.5236 120.7914 60.6961 63.4268 174.2690 114 N 4.7101 9.9108 122.5517 53.3005 37.4558 174.9370 115 D 4.8223 8.6021 117.8333 54.6924 42.1505 175.7082 116 T 4.8363 8.4075 110.3416 60.4347 71.1526 173.6758 117 L 4.9476 8.9832 122.2651 53.2084 46.4687 174.9178 118 D 5.3170 8.8731 120.9491 52.8843 43.4126 175.4645 119 I 4.7486 8.5996 124.2562 60.0430 39.4834 175.3212 120 V 4.8786 8.6048 119.1163 59.0082 36.7852 174.7547 121 L 4.4962 8.5803 122.8285 55.0214 42.1208 177.6718 122 T 4.2617 8.3278 115.2800 61.9252 70.2092 176.3145 123 G 3.7835 8.3823 109.9763 44.5772 0.0000 171.1712 124 P 4.5730 0.0000 0.0000 61.6055 32.5770 176.1301 125 A 3.9440 8.4485 121.6818 53.2916 18.5873 177.0155 126 Q 4.5476 8.6553 120.4592 54.0783 31.9497 174.3392 127 N 5.1021 8.6210 122.0028 52.6004 40.4757 173.4472 128 V 4.3518 8.4058 127.7640 61.3343 33.4932 175.1134 129 T 4.4652 8.6668 124.7971 62.9067 69.3137 174.4246 130 A 3.9599 8.7486 128.6938 53.1710 18.6816 176.0782 131 D 4.2983 8.0059 121.1481 54.5380 44.5770 174.8017 132 T 4.6153 7.5964 116.9201 61.8640 70.8687 173.3529 133 Y 5.0232 8.6166 124.0385 55.3726 40.1896 173.8820 134 P 4.5868 0.0000 0.0000 62.3585 32.5174 175.7116 135 I 4.8632 8.2663 120.8958 59.8820 40.4445 174.9040 136 T 4.7947 8.5185 119.7569 61.7618 72.0591 172.8274 137 L 5.0449 8.6233 124.5062 52.9687 45.6126 175.3042 138 D 5.1019 9.0714 121.8376 52.6495 43.3535 175.5288 139 V 5.3192 8.5802 122.7681 61.3385 34.3850 174.8459 140 V 4.4914 9.1975 125.2236 59.9281 35.1897 173.9686 141 G 4.0526 8.5856 110.5675 46.6441 0.0000 172.3466 142 Y 4.4750 9.1312 128.2526 56.3422 40.6619 175.3796 143 Q 3.9172 5.9361 124.6422 53.8731 30.7462 172.8609 144 P 4.3129 0.0000 0.0000 62.7994 31.6772 175.8494 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 G 8.34 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 2 S 7.88 4.51 0.00 4.04 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 3 F 9.56 4.34 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 4 L 8.22 4.57 0.00 1.77 1.64 0.90 0.98 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 5 P 0.00 4.28 0.00 2.23 2.34 0.00 3.74 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 6 N 8.13 4.53 0.00 2.75 2.93 0.00 0.00 6.86 7.57 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 7 S 7.89 4.53 0.00 3.99 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 8 E 7.84 4.14 0.00 2.01 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 0.00 2.33 2.30 0.00 9 Q 8.31 4.56 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.48 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 10 Q 8.57 4.62 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 11 K 8.44 4.67 0.00 1.68 1.61 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.48 7.81 12 S 8.50 4.79 0.00 3.84 3.69 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 0.00 0.00 0.00 0.00 13 V 8.02 4.56 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 0.72 0.00 0.00 0.93 0.00 0.00 14 D 8.45 4.91 0.00 2.63 2.58 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 15 I 8.19 4.41 2.03 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 1.35 0.91 0.73 0.00 0.00 16 V 7.94 4.36 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 0.83 0.00 0.00 0.91 0.00 0.00 17 F 8.80 4.58 0.00 2.95 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 18 S 8.24 4.52 0.00 3.79 3.67 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 19 S 8.41 4.57 0.00 3.88 3.85 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 20 P 0.00 4.25 0.00 1.96 1.96 0.00 3.56 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 2.06 2.07 0.00 21 Q 8.59 4.35 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 22 D 7.93 4.94 0.00 2.77 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 23 L 8.04 4.94 0.00 1.44 1.68 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 T 9.13 4.76 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 1.20 0.00 0.00 25 V 8.07 4.90 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 0.77 0.00 0.00 0.84 0.00 0.00 26 S 8.98 4.67 0.00 3.73 3.67 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 27 L 8.58 5.01 0.00 1.59 1.54 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.82 4.46 1.88 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 0.62 0.92 0.00 0.00 29 P 0.00 4.79 0.00 1.95 2.01 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 30 V 8.44 3.97 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 0.78 0.00 0.00 0.92 0.00 0.00 31 S 8.68 4.33 0.00 4.02 3.85 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 32 G 8.78 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 33 L 7.84 4.15 0.00 1.66 1.62 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.29 4.56 0.00 1.69 1.68 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.33 7.81 35 A 8.38 4.20 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 36 G 8.97 3.83 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 0.00 0.00 0.00 37 K 8.41 4.40 0.00 1.77 1.73 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.46 7.81 38 N 8.88 5.05 0.00 2.70 2.66 0.00 0.00 7.04 6.89 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 39 A 8.33 4.20 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 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.19 0.00 1.93 1.97 0.00 3.82 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 41 S 9.05 4.11 0.00 3.98 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 42 A 7.47 4.08 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 0.00 0.00 0.00 0.00 0.00 43 K 8.67 4.57 0.00 1.64 1.74 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.42 7.81 44 I 9.06 4.59 1.82 0.00 0.00 0.72 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 1.18 0.88 0.00 0.00 45 A 7.76 5.05 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 46 K 9.13 4.83 0.00 1.79 1.65 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.35 7.81 47 L 8.93 4.99 0.00 1.81 1.53 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 48 V 9.10 4.67 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 1.01 0.00 0.00 0.96 0.00 0.00 49 V 8.08 4.58 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 0.00 0.00 0.48 0.00 0.00 -0.17 0.00 0.00 50 N 9.03 5.24 0.00 2.65 2.64 0.00 0.00 6.09 6.25 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 51 S 8.63 4.73 0.00 3.89 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.16 4.37 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 53 T 7.69 4.15 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 54 L 7.52 5.02 0.00 1.73 1.59 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.94 4.50 0.00 1.63 1.72 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.40 7.81 56 E 8.16 4.54 0.00 2.23 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 2.40 2.36 0.00 57 F 9.75 5.07 0.00 3.10 3.21 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 58 G 9.84 4.67 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 0.00 0.00 0.00 59 V 8.75 5.64 2.51 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 0.90 0.00 0.00 1.09 0.00 0.00 60 R 9.22 4.66 0.00 1.20 1.32 0.00 2.21 0.00 0.00 2.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.50 0.00 61 G 8.47 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 0.00 0.00 0.00 0.00 0.00 0.00 62 I 7.36 4.42 1.71 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.89 0.82 0.00 0.00 63 S 7.98 4.47 0.00 4.07 3.96 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 64 N 8.74 4.68 0.00 2.77 2.91 0.00 0.00 6.50 8.00 0.00 0.00 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 N 8.09 4.85 0.00 2.77 2.71 0.00 0.00 6.75 7.80 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 66 V 7.90 4.41 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 0.91 0.00 0.00 0.87 0.00 0.00 67 V 8.52 4.38 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 0.88 0.00 0.00 1.00 0.00 0.00 68 D 7.57 4.90 0.00 2.85 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 69 S 8.66 4.30 0.00 3.99 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 70 T 7.95 4.26 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 1.22 0.00 0.00 71 G 8.01 3.83 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 0.00 0.00 0.00 72 T 8.29 4.86 4.41 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 1.43 0.00 0.00 73 A 8.12 5.28 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 0.00 0.00 0.00 0.00 0.00 74 W 8.73 5.21 0.00 3.49 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 75 R 9.09 5.14 0.00 1.72 1.85 0.00 3.10 0.00 0.00 3.45 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 76 V 8.71 4.78 2.36 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 1.01 0.00 0.00 0.99 0.00 0.00 77 A 8.64 5.23 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 78 G 9.12 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 0.00 0.00 0.00 79 K 8.80 3.98 0.00 1.60 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.52 7.81 80 N 8.63 4.60 0.00 2.69 2.82 0.00 0.00 6.93 7.44 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 81 T 8.20 4.30 4.23 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 1.19 0.00 0.00 82 G 8.19 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 83 K 7.83 4.27 0.00 1.87 1.84 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.45 7.81 84 E 8.78 5.33 0.00 1.88 1.89 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 2.38 2.35 0.00 85 I 8.70 4.62 1.70 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.68 0.54 0.00 0.00 86 G 8.79 4.23 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 0.00 87 V 8.69 4.74 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 0.46 0.00 0.00 -0.16 0.00 0.00 88 G 7.29 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 89 L 8.53 4.82 0.00 1.62 1.64 0.96 0.78 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 90 S 8.88 4.33 0.00 3.98 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 91 S 8.67 4.14 0.00 3.89 3.96 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 92 D 8.00 4.36 0.00 2.66 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 93 S 8.19 4.33 0.00 4.04 3.86 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 0.00 0.00 0.00 0.00 94 L 8.34 4.25 0.00 1.90 1.81 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 95 R 7.99 4.22 0.00 1.97 2.01 0.00 3.16 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 96 R 7.60 4.59 0.00 2.10 2.05 0.00 3.21 0.00 0.00 3.43 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 97 S 7.10 3.67 0.00 3.32 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 98 D 8.53 4.45 0.00 2.35 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 99 S 8.24 4.32 0.00 3.69 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 0.00 100 T 8.23 4.78 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 1.20 0.00 0.00 101 E 9.44 4.32 0.00 1.30 1.17 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 1.74 1.47 0.00 102 K 8.06 4.98 0.00 1.73 1.79 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.41 7.81 103 W 9.39 4.67 0.00 3.46 3.25 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 0.00 104 N 10.09 4.29 0.00 2.96 2.94 0.00 0.00 7.43 7.65 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 0.00 105 G 8.91 4.23 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 0.00 106 V 8.58 3.86 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 0.87 0.00 0.00 0.90 0.00 0.00 107 N 8.80 5.24 0.00 2.75 2.76 0.00 0.00 6.89 7.68 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 0.00 108 W 9.87 5.18 0.00 3.12 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 0.00 109 M 8.91 4.82 0.00 1.86 2.19 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.50 0.00 110 T 8.62 4.71 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 0.96 0.00 0.00 111 F 8.66 4.92 0.00 1.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.71 4.60 0.00 2.85 2.90 0.00 0.00 6.91 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 0.00 113 S 9.52 4.42 0.00 3.83 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 0.00 114 N 9.91 4.71 0.00 2.66 3.36 0.00 0.00 7.07 7.94 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 0.00 115 D 8.60 4.82 0.00 3.07 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 0.00 116 T 8.41 4.84 4.26 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 1.23 0.00 0.00 117 L 8.98 4.95 0.00 1.51 1.45 0.20 0.79 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 0.00 118 D 8.87 5.32 0.00 2.56 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 0.00 119 I 8.60 4.75 1.86 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.04 0.83 0.00 0.00 120 V 8.60 4.88 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 0.91 0.00 0.00 121 L 8.58 4.50 0.00 1.50 1.49 0.82 0.90 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 0.00 122 T 8.33 4.26 4.16 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 0.00 0.00 0.00 1.10 0.00 0.00 123 G 8.38 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 0.00 124 P 0.00 4.57 0.00 1.93 2.00 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 125 A 8.45 3.94 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 0.00 126 Q 8.66 4.55 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 127 N 8.62 5.10 0.00 2.75 2.70 0.00 0.00 6.69 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 0.00 128 V 8.41 4.35 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 0.63 0.00 0.00 0.80 0.00 0.00 129 T 8.67 4.47 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 1.24 0.00 0.00 130 A 8.75 3.96 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 0.00 131 D 8.01 4.30 0.00 2.49 1.72 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.60 4.62 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 1.21 0.00 0.00 133 Y 8.62 5.02 0.00 2.80 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 0.00 134 P 0.00 4.59 0.00 2.24 2.09 0.00 3.96 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 135 I 8.27 4.86 2.01 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 0.80 1.30 0.00 0.00 136 T 8.52 4.79 4.39 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 1.19 0.00 0.00 137 L 8.62 5.04 0.00 1.51 1.55 1.03 1.15 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 0.00 138 D 9.07 5.10 0.00 2.68 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 0.00 139 V 8.58 5.32 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 0.96 0.00 0.00 140 V 9.20 4.49 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 -0.19 0.00 0.00 0.54 0.00 0.00 141 G 8.59 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 0.00 0.00 0.00 142 Y 9.13 4.48 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 0.00 143 Q 5.94 3.92 0.00 1.71 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 144 P 0.00 4.31 0.00 2.22 2.11 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.20 0.00