NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7596 8.4449 117.8349 56.2553 29.9843 172.9033 1D H 4.6475 8.6827 118.6017 55.6434 29.6119 172.9687 1E H 5.0904 7.5926 115.7604 53.5653 33.4305 172.0779 1F H 4.6123 8.8949 117.1411 55.9553 28.9895 174.2943 1G F 4.8421 8.3601 119.4605 57.7967 39.7982 174.2314 2 N 4.6509 8.4920 117.5265 52.4316 39.0365 174.6808 3 L 4.7745 8.0789 123.3721 52.0585 43.9984 174.6688 4 P 4.4759 0.0000 0.0000 61.5906 32.2369 174.2249 5 P 4.3750 0.0000 0.0000 61.9687 32.5885 175.3673 6 G 3.8413 9.3629 104.4616 45.0090 0.0000 171.1922 7 N 4.4577 7.7299 113.9995 51.9069 40.0096 173.7773 8 Y 4.7949 8.1133 114.3548 57.9511 38.7657 176.7325 9 K 4.0650 8.1806 121.0264 58.9747 32.2690 177.2289 10 K 4.6803 7.6187 115.1603 53.3311 34.7736 173.7966 11 P 4.7644 0.0000 0.0000 63.4410 32.3567 174.9101 12 K 4.8883 9.4475 118.5086 55.4778 37.3128 175.2332 13 L 5.2443 9.2963 121.5586 53.4399 44.6594 176.1997 14 L 5.2129 8.8569 121.2181 53.4984 44.3096 174.6055 15 Y 4.9899 9.3442 126.9642 56.3358 40.6607 173.8780 16 C 3.4513 8.7795 128.6933 58.2059 32.1180 174.2354 17 S 3.9320 8.1954 121.8966 61.2870 61.7306 174.4016 18 N 3.8045 7.1854 116.0931 56.3241 38.7805 174.7184 19 G 3.8877 7.4828 104.8067 44.5268 0.0000 172.6160 20 G 3.1584 7.2906 106.2776 44.5838 0.0000 173.6570 21 H 4.7400 7.1825 114.7256 53.5967 32.2392 174.3996 22 F 5.3250 8.7977 120.5614 56.2541 40.2383 175.3527 23 L 4.6971 9.4424 126.2251 55.5878 43.3962 175.7066 24 R 5.1618 9.3498 124.8975 54.9023 34.0336 173.6864 25 I 4.9741 8.2718 126.7391 59.4434 39.3340 175.7218 26 L 4.1033 8.9849 128.1499 53.4072 42.3115 176.6573 27 P 4.2895 0.0000 0.0000 65.9320 31.2243 177.3460 28 D 4.4787 7.9476 114.4594 53.8897 39.9933 176.9272 29 G 4.2002 8.6364 109.9052 45.2191 0.0000 173.7952 30 T 4.3997 8.6572 118.0050 63.2702 69.1004 173.6325 31 V 4.9127 7.8102 124.6724 61.2949 34.2446 174.3756 32 D 4.5675 8.4471 123.9187 53.2319 43.1058 174.2745 33 G 4.6105 8.6701 104.8758 45.3067 0.0000 172.6526 34 T 5.0045 8.8488 114.9819 60.6460 70.9593 174.7120 35 R 4.2003 8.8515 124.9694 56.9224 30.9725 176.3710 36 D 4.5705 8.1390 118.5459 53.8517 40.0342 176.7518 37 R 3.7732 8.6680 126.6877 58.3645 30.2422 177.9631 38 S 4.4830 8.4053 111.5688 57.8524 63.4311 173.9551 39 D 4.3791 7.9080 121.6123 55.0183 41.2919 175.8430 40 Q 4.2892 8.4688 123.5144 56.5195 29.0385 175.6732 41 H 4.7936 9.0266 116.0234 55.4886 29.5817 174.3782 42 I 4.6077 7.1942 109.6546 59.9105 38.4265 174.7962 43 Q 4.5063 7.3217 122.7786 54.8633 30.4454 174.5124 44 F 5.2674 9.2670 122.8466 55.6012 43.3734 173.7968 45 Q 4.8620 9.4850 124.4718 54.6092 30.5869 174.2411 46 L 5.3518 8.6766 126.6595 53.5253 43.8049 176.1456 47 S 4.4961 8.5064 115.0956 56.5692 66.9502 172.4504 48 A 4.5361 8.1182 123.6169 50.9718 19.4310 176.4378 49 E 4.0923 9.0462 125.6572 57.7657 30.4482 176.7085 50 S 4.8106 7.3757 112.2002 55.6930 66.6030 173.6612 51 V 3.7880 8.3305 121.2749 65.0590 31.3629 176.3447 52 G 3.9464 9.2740 115.3918 45.0734 0.0000 171.7291 53 E 5.1199 8.4392 120.2678 54.6971 32.1487 175.6349 54 V 4.9326 8.9271 116.3465 60.0255 36.9443 173.8167 55 Y 5.3126 8.7797 119.4162 56.5387 41.3706 175.4448 56 I 4.4663 8.5789 122.1217 59.6271 40.2912 173.9056 57 K 4.7448 8.6661 129.1298 53.9981 34.8049 175.1717 58 S 4.3572 9.0249 123.5435 58.5961 62.6077 174.9561 59 T 3.7840 8.5054 118.8138 64.6081 68.7552 175.9058 60 E 4.0016 8.1805 122.5802 58.4111 29.8420 177.0379 61 T 4.3094 7.9138 106.0278 60.6063 70.1124 175.4495 62 G 3.8330 8.2350 109.9812 45.4503 0.0000 173.7682 63 Q 4.4433 7.6546 119.1016 56.0466 30.2579 174.6809 64 Y 4.7282 9.1369 120.9879 56.2997 40.0503 175.0623 65 L 4.3685 9.1211 126.4744 55.4930 43.4052 175.5513 66 A 4.9991 8.5589 125.6940 51.0217 23.2564 174.4679 67 M 5.3482 8.6354 119.5459 53.8075 34.7518 175.6929 68 D 5.2487 9.5047 126.6587 52.6126 41.0402 176.9211 69 T 3.9963 8.5831 112.8978 64.9013 67.2500 174.0398 70 D 4.7835 8.4138 119.1061 53.9363 41.1951 177.0149 71 G 3.3846 8.5232 107.2798 45.5126 0.0000 173.4342 72 L 4.7170 8.2374 120.4282 53.1775 42.9223 176.2005 73 L 5.0682 8.3564 122.9359 55.2402 42.7588 175.5200 74 Y 4.9561 8.8950 119.0841 56.1800 41.9898 173.3946 75 G 4.2269 8.8126 108.3125 45.1808 0.0000 173.1212 76 S 5.0564 9.0647 121.2350 56.7514 63.8673 175.3366 77 Q 4.3261 9.1167 126.0863 58.2019 28.9379 176.5277 78 T 4.7142 7.5454 105.9853 58.4493 71.6794 171.6511 79 P 3.7061 0.0000 0.0000 62.5085 31.7702 175.2015 80 N 5.0356 8.2296 118.8981 50.7627 40.9022 174.5351 81 E 3.8511 8.7237 114.8455 59.3119 29.6406 178.2426 82 E 4.1691 8.8769 118.1668 57.4577 29.7261 177.3227 83 C 4.8769 7.9159 115.5337 58.9082 29.1559 173.3746 84 L 4.3306 6.9318 120.6974 53.5568 42.7867 175.8271 85 F 5.2074 8.7891 121.4911 55.5479 43.5418 174.2598 86 L 4.7663 9.2236 122.9750 54.0140 42.6262 175.5040 87 E 4.5868 8.8838 126.8704 55.1506 30.2901 175.5658 88 R 4.8256 8.4235 125.1422 54.0853 34.8792 174.6224 89 L 4.7606 8.7046 123.4005 55.2371 43.2326 175.7359 90 E 4.6910 9.1033 123.7944 55.4342 33.6444 174.7796 91 E 4.0070 9.6547 123.6861 57.7600 27.3078 174.1290 92 N 4.3185 8.4913 110.7868 54.0759 36.6051 174.1714 93 H 4.8145 8.4782 116.1494 57.6820 37.2524 173.3955 94 Y 4.6908 7.8523 116.0431 57.4298 40.2147 173.4487 95 N 5.6075 9.6238 117.9770 51.9023 41.5071 174.5283 96 T 5.2942 8.8876 113.0449 60.1849 72.7490 172.8126 97 Y 4.9717 8.6409 119.1733 56.6289 41.6425 174.1324 98 I 4.6176 8.5313 126.0864 59.1760 39.4587 175.5389 99 S 4.0744 8.9839 122.5166 58.8232 62.3890 174.1817 100 K 3.9650 8.8022 129.2064 59.3283 32.3540 178.6193 101 K 3.7181 7.9490 118.3910 59.2226 32.1090 176.9813 102 H 4.6354 7.8443 114.7813 55.0558 29.3470 176.3573 103 A 3.9173 7.6770 126.0254 55.1075 18.3279 180.8212 104 E 3.8534 7.9613 112.6368 58.6367 29.7714 177.7218 105 K 4.1317 7.7587 117.3890 55.5087 32.6677 175.8280 106 N 3.9264 7.5627 115.5663 53.9495 36.4749 174.5981 107 W 4.9788 7.7337 117.6143 56.0076 30.8783 177.1649 108 F 5.4437 9.3590 123.9570 55.6197 41.5527 175.3404 109 V 4.1259 8.8328 121.5515 62.5908 31.9038 175.5177 110 G 4.4338 8.6356 112.8178 45.4929 0.0000 171.5183 111 L 5.2839 8.1176 120.4709 52.5045 45.3581 177.1137 112 K 4.1233 8.9443 122.5047 55.3373 33.0036 178.4476 113 K 3.8674 8.4118 119.4729 59.3249 31.9200 177.9127 114 N 4.5555 8.0700 113.8893 52.6021 37.7778 175.8494 115 G 3.5042 8.1979 108.1519 45.5128 0.0000 173.6711 116 S 4.8454 8.0469 114.5942 56.9610 64.5713 173.3931 117 C 4.7775 8.2942 119.4007 59.8661 28.6634 173.4878 118 K 4.3558 8.6808 122.4297 55.7242 33.0612 176.6992 119 R 4.0307 8.5986 123.8986 55.9248 31.2679 177.1284 120 G 3.2036 8.8021 115.2208 48.3204 0.0000 174.1763 121 P 4.1937 0.0000 0.0000 64.3830 31.4641 177.6986 122 R 4.2360 7.9165 115.8790 56.7788 30.3802 176.4072 123 T 5.1577 7.6840 108.3234 60.0188 70.7488 173.4745 124 H 4.8018 7.9192 115.2276 54.8901 30.6437 173.0109 125 Y 3.9764 8.6961 118.5105 59.9043 38.1279 176.9384 126 G 4.0638 9.0289 111.3398 45.5043 0.0000 173.9874 127 Q 4.2332 7.3785 118.6755 55.0998 29.8302 177.0722 128 K 3.8148 8.2525 118.9549 58.6137 32.9286 179.3396 129 A 3.8930 8.0672 121.3188 53.9679 18.2449 178.4663 130 I 4.3150 7.2122 106.1251 61.0398 38.4663 175.1991 131 L 4.3571 7.3002 123.3595 53.7640 42.7071 175.7635 132 W 5.4050 9.3222 123.7920 54.7204 33.3005 174.5117 133 L 5.2998 9.3568 124.8305 52.6777 44.2688 173.5914 134 P 5.1977 0.0000 0.0000 62.6745 32.3455 175.6214 135 L 4.9886 9.1862 123.8154 51.9546 45.3755 174.4310 136 P 4.6658 0.0000 0.0000 62.5509 32.3129 176.9982 137 V 3.7614 8.2181 114.6819 61.8010 31.5849 176.2957 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 1C H 8.44 4.76 0.00 3.12 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.68 4.65 0.00 3.20 3.24 0.00 5.64 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 1E H 7.59 5.09 0.00 3.14 3.28 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.89 4.61 0.00 3.33 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.36 4.84 0.00 2.90 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 2 N 8.49 4.65 0.00 2.96 2.79 0.00 0.00 6.88 6.74 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 3 L 8.08 4.77 0.00 1.49 1.41 0.68 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.48 0.00 2.16 2.12 0.00 3.68 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 1.95 1.91 0.00 5 P 0.00 4.37 0.00 2.17 2.09 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 1.94 1.93 0.00 6 G 9.36 3.84 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 0.00 0.00 0.00 7 N 7.73 4.46 0.00 2.64 2.66 0.00 0.00 5.84 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 8 Y 8.11 4.79 0.00 3.04 3.27 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 9 K 8.18 4.07 0.00 1.89 1.92 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.57 7.81 10 K 7.62 4.68 0.00 1.73 1.71 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 P 0.00 4.76 0.00 2.06 2.07 0.00 3.77 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 1.98 1.99 0.00 12 K 9.45 4.89 0.00 1.70 1.90 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.60 1.66 7.81 13 L 9.30 5.24 0.00 1.75 1.72 0.60 0.81 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 14 L 8.86 5.21 0.00 1.44 1.33 0.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.34 4.99 0.00 3.29 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 16 C 8.78 3.45 0.00 1.54 2.12 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.20 3.93 0.00 3.70 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.19 3.80 0.00 2.45 2.52 0.00 0.00 6.73 7.98 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 19 G 7.48 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 20 G 7.29 3.16 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 0.00 0.00 0.00 0.00 21 H 7.18 4.74 0.00 2.96 3.23 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.80 5.33 0.00 3.26 3.10 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 23 L 9.44 4.70 0.00 1.64 1.49 0.91 -0.14 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 24 R 9.35 5.16 0.00 2.02 2.13 0.00 3.27 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.83 0.00 25 I 8.27 4.97 2.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.18 0.96 0.00 0.00 26 L 8.98 4.10 0.00 1.80 1.53 0.93 0.75 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 27 P 0.00 4.29 0.00 2.00 2.12 0.00 3.54 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 28 D 7.95 4.48 0.00 2.78 2.79 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 29 G 8.64 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 30 T 8.66 4.40 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 1.24 0.00 0.00 31 V 7.81 4.91 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 0.93 0.00 0.00 1.03 0.00 0.00 32 D 8.45 4.57 0.00 2.72 2.77 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 0.00 0.00 0.00 0.00 33 G 8.67 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.85 5.00 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 1.39 0.00 0.00 35 R 8.85 4.20 0.00 1.87 1.99 0.00 3.20 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 36 D 8.14 4.57 0.00 2.85 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 37 R 8.67 3.77 0.00 1.86 1.92 0.00 3.42 0.00 0.00 3.37 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.88 0.00 38 S 8.41 4.48 0.00 3.93 3.95 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 39 D 7.91 4.38 0.00 2.82 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 40 Q 8.47 4.29 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.21 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 41 H 9.03 4.79 0.00 3.25 3.34 0.00 5.76 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.19 4.61 1.91 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.98 1.09 0.00 0.00 43 Q 7.32 4.51 0.00 1.83 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.88 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 44 F 9.27 5.27 0.00 2.83 2.78 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 45 Q 9.49 4.86 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 46 L 8.68 5.35 0.00 1.80 1.57 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.51 4.50 0.00 3.87 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 48 A 8.12 4.54 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 49 E 9.05 4.09 0.00 1.79 1.79 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 2.25 2.30 0.00 50 S 7.38 4.81 0.00 4.02 3.76 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 51 V 8.33 3.79 2.30 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 0.98 0.00 0.00 1.04 0.00 0.00 52 G 9.27 3.95 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 0.00 0.00 0.00 53 E 8.44 5.12 0.00 2.03 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 2.20 2.28 0.00 54 V 8.93 4.93 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 0.74 0.00 0.00 1.21 0.00 0.00 55 Y 8.78 5.31 0.00 2.99 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 56 I 8.58 4.47 1.60 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.51 0.24 0.00 0.00 57 K 8.67 4.74 0.00 1.16 1.52 0.00 1.30 0.00 0.00 0.62 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.01 0.85 7.81 58 S 9.02 4.36 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 59 T 8.51 3.78 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 1.14 0.00 0.00 60 E 8.18 4.00 0.00 1.84 1.92 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 2.20 2.31 0.00 61 T 7.91 4.31 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 1.23 0.00 0.00 62 G 8.24 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 63 Q 7.65 4.44 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.78 0.00 0.00 0.00 0.00 0.00 2.56 2.35 0.00 64 Y 9.14 4.73 0.00 2.90 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 65 L 9.12 4.37 0.00 1.44 1.38 0.74 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.56 5.00 0.64 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 67 M 8.64 5.35 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.72 0.00 68 D 9.50 5.25 0.00 2.93 2.81 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 69 T 8.58 4.00 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 1.27 0.00 0.00 70 D 8.41 4.78 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.52 3.38 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 0.00 72 L 8.24 4.72 0.00 1.97 1.63 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.36 5.07 0.00 1.59 1.63 0.93 0.94 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 74 Y 8.90 4.96 0.00 3.02 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 75 G 8.81 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 76 S 9.06 5.06 0.00 3.79 3.77 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 0.00 0.00 0.00 0.00 77 Q 9.12 4.33 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.53 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 78 T 7.55 4.71 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 1.23 0.00 0.00 79 P 0.00 3.71 0.00 1.49 0.49 0.00 3.52 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.48 0.00 80 N 8.23 5.04 0.00 2.91 2.92 0.00 0.00 6.00 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 81 E 8.72 3.85 0.00 2.06 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 0.00 2.33 2.26 0.00 82 E 8.88 4.17 0.00 2.34 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 2.39 2.34 0.00 83 C 7.92 4.88 0.00 3.22 3.23 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 84 L 6.93 4.33 0.00 1.42 1.27 0.74 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.79 5.21 0.00 3.02 3.03 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 86 L 9.22 4.77 0.00 1.50 1.58 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.88 4.59 0.00 2.12 1.91 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 2.15 1.90 0.00 88 R 8.42 4.83 0.00 1.81 1.90 0.00 3.17 0.00 0.00 2.88 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 89 L 8.70 4.76 0.00 1.52 1.60 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.10 4.69 0.00 2.24 1.86 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 2.29 2.43 0.00 91 E 9.65 4.01 0.00 2.40 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 2.28 2.38 0.00 92 N 8.49 4.32 0.00 2.83 2.88 0.00 0.00 6.86 8.16 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 93 H 8.48 4.81 0.00 2.87 2.99 0.00 5.94 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 94 Y 7.85 4.69 0.00 3.08 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 95 N 9.62 5.61 0.00 3.02 2.56 0.00 0.00 6.98 7.00 0.00 0.00 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 T 8.89 5.29 4.57 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 1.37 0.00 0.00 97 Y 8.64 4.97 0.00 2.71 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 98 I 8.53 4.62 1.69 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.28 0.57 0.00 0.00 99 S 8.98 4.07 0.00 4.08 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 0.00 100 K 8.80 3.97 0.00 1.69 1.63 0.00 1.59 0.00 0.00 1.44 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.29 7.81 101 K 7.95 3.72 0.00 1.56 1.63 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.25 1.00 7.81 102 H 7.84 4.64 0.00 2.90 2.07 0.00 5.68 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 0.00 103 A 7.68 3.92 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 0.00 104 E 7.96 3.85 0.00 1.80 1.88 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 2.09 2.13 0.00 105 K 7.76 4.13 0.00 0.91 1.51 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.04 7.81 106 N 7.56 3.93 0.00 3.02 3.03 0.00 0.00 6.90 7.83 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 0.00 107 W 7.73 4.98 0.00 3.28 3.10 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 0.00 108 F 9.36 5.44 0.00 2.84 3.03 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 0.00 109 V 8.83 4.13 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 0.41 0.00 0.00 0.41 0.00 0.00 110 G 8.64 4.43 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 0.00 111 L 8.12 5.28 0.00 1.35 1.39 1.00 1.01 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 0.00 112 K 8.94 4.12 0.00 1.91 1.67 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.41 3.87 0.00 1.69 1.83 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.40 7.81 114 N 8.07 4.56 0.00 2.78 2.89 0.00 0.00 6.14 7.00 0.00 0.00 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 G 8.20 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.05 4.85 0.00 3.99 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 0.00 117 C 8.29 4.78 0.00 2.90 2.93 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 0.00 118 K 8.68 4.36 0.00 1.73 1.69 0.00 1.60 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.32 7.81 119 R 8.60 4.03 0.00 1.79 1.62 0.00 3.22 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 120 G 8.80 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 0.00 0.00 0.00 121 P 0.00 4.19 0.00 1.91 2.18 0.00 3.07 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 122 R 7.92 4.24 0.00 1.82 1.93 0.00 3.28 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 123 T 7.68 5.16 4.34 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 1.28 0.00 0.00 124 H 7.92 4.80 0.00 3.46 3.52 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.70 3.98 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 0.00 126 G 9.03 4.06 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 0.00 0.00 0.00 127 Q 7.38 4.23 0.00 1.79 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.74 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 128 K 8.25 3.81 0.00 1.73 1.61 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.25 7.81 129 A 8.07 3.89 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 0.00 130 I 7.21 4.32 1.61 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.39 0.50 0.00 0.00 131 L 7.30 4.36 0.00 1.09 0.65 0.40 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.32 5.41 0.00 3.68 3.31 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 0.00 133 L 9.36 5.30 0.00 2.11 1.75 0.81 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.20 0.00 2.23 2.21 0.00 3.88 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 2.06 2.11 0.00 135 L 9.19 4.99 0.00 1.68 1.64 1.10 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.67 0.00 1.94 1.99 0.00 3.70 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 2.04 2.14 0.00 137 V 8.22 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 0.67 0.00 0.00 0.91 0.00 0.00