NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7733 8.4449 117.8385 56.2239 29.9920 172.8680 1D H 4.6575 8.7632 119.5400 55.5984 29.8735 172.7636 1E H 5.1184 7.6206 115.5553 53.4525 33.2771 172.0723 1F H 4.6123 8.9319 116.9844 56.0077 28.9562 174.3322 1G F 4.7675 8.4021 119.4983 57.7668 39.9007 174.4240 2 N 4.6805 8.3986 117.7470 52.2668 38.9337 174.5777 3 L 4.7069 8.0452 123.3953 52.2463 43.6330 174.9405 4 P 4.4252 0.0000 0.0000 61.5807 31.9982 174.7764 5 P 4.3733 0.0000 0.0000 62.7831 32.2695 176.7117 6 G 3.9357 8.7881 104.5275 45.6187 0.0000 172.2972 7 N 4.5738 7.9292 116.2287 51.1413 40.0298 174.1832 8 Y 4.8441 7.9101 115.4502 58.2051 38.4034 177.0488 9 K 4.0490 7.9583 121.2864 59.2072 32.2229 177.2714 10 K 4.6591 7.5926 115.5255 53.3998 34.6948 173.9478 11 P 4.8505 0.0000 0.0000 63.2920 32.5209 174.4995 12 K 4.7026 9.1502 118.7789 56.2378 36.8013 174.2123 13 L 5.1215 9.2120 120.1227 52.9849 44.5467 176.2310 14 L 4.9627 8.6854 123.9215 53.8881 42.9138 174.7949 15 Y 4.7433 9.4817 127.5163 56.7574 40.4758 173.5933 16 C 4.4066 8.5140 128.3821 57.6008 32.3905 174.3977 17 S 4.0507 8.1189 121.6888 60.9838 62.7076 175.3578 18 N 4.1900 8.1535 119.0914 56.1837 38.5894 175.4097 19 G 3.9177 7.6916 102.4423 44.5033 0.0000 172.8283 20 G 3.1955 7.7758 107.4737 46.3230 0.0000 173.1762 21 H 4.8281 7.3538 114.9016 53.7324 32.1440 173.6378 22 F 5.3263 9.0636 119.6639 55.4618 41.1045 175.3216 23 L 4.4924 9.0003 125.8888 55.6501 43.0637 175.6182 24 R 4.9393 9.7918 127.2956 54.6068 33.4553 174.1140 25 I 4.6519 8.2448 126.9062 59.3049 38.7369 175.6859 26 L 4.0611 8.6400 127.6720 53.5137 42.3642 176.9206 27 P 4.2215 0.0000 0.0000 65.9334 31.2247 177.7814 28 D 4.3984 7.9200 114.7446 54.4480 39.6504 176.8411 29 G 4.1120 8.2975 109.0334 45.1441 0.0000 173.2371 30 T 4.5142 7.9037 114.5268 61.0496 68.4024 173.2013 31 V 4.9194 7.9496 126.8433 61.2649 34.0881 174.5370 32 D 4.5903 8.5699 124.8572 53.0181 42.7224 174.0282 33 G 4.9711 8.5291 104.7031 45.1325 0.0000 172.1991 34 T 4.9692 8.4692 115.3597 60.5026 71.1223 174.2405 35 R 4.0325 8.6907 122.2522 56.8182 31.8390 176.2053 36 D 4.4812 7.9644 117.7845 54.1844 40.6586 176.9045 37 R 3.9167 8.6159 126.7286 58.1656 30.3006 178.0207 38 S 4.2887 8.1150 111.6675 59.0558 63.6408 174.2056 39 D 4.3057 7.6410 121.3410 55.2554 41.0984 175.6642 40 Q 4.4984 8.5681 124.3661 56.4646 28.8754 175.5502 41 H 5.0100 8.8599 115.5700 55.5459 29.5455 174.9931 42 I 4.6063 7.6383 111.2204 59.7250 39.1504 175.1737 43 Q 4.1842 7.9270 121.2337 55.8796 29.4644 174.6529 44 L 5.0858 8.9630 125.2743 52.7843 44.9119 175.4373 45 Q 4.8014 9.3474 125.2062 54.5836 30.6860 174.2934 46 L 5.5861 8.8173 126.1450 52.7512 44.0845 175.9263 47 S 4.5650 8.1658 114.3763 56.8149 66.7636 172.2576 48 A 5.1481 8.2995 122.8580 51.2203 20.3500 174.5361 49 E 3.8899 9.1191 122.9910 57.2664 29.1188 178.7329 50 S 4.7065 8.4000 117.1150 56.7478 66.2087 173.0314 51 V 3.8512 8.2266 121.1981 64.6891 31.6000 176.7431 52 G 3.9086 9.2031 114.9893 45.2391 0.0000 171.8673 53 E 5.1106 7.8537 119.4462 54.6524 32.2259 175.5890 54 V 4.9066 8.8739 116.0200 59.8356 37.0098 173.8535 55 Y 5.0854 8.8591 120.3523 56.4605 40.8540 174.8463 56 I 4.4039 8.6692 125.3412 59.7242 39.0759 174.3608 57 K 4.6390 8.7015 129.2564 54.1355 35.2216 174.9618 58 S 4.4539 8.7794 123.0459 58.1774 62.6698 174.6261 59 T 3.7450 8.4718 118.9962 65.1840 68.5396 175.5803 60 E 3.9999 8.4617 121.9554 58.8358 29.8024 177.4870 61 T 4.1845 7.5072 105.3488 61.2246 69.7308 175.7351 62 G 3.7603 8.4395 110.2912 45.9078 0.0000 173.0673 63 Q 4.5583 7.5535 118.9466 55.1933 30.2838 174.8801 64 Y 4.5548 9.3937 121.7077 56.8855 40.0510 174.3872 65 L 4.6444 8.7576 125.2283 54.9306 43.4676 175.0358 66 C 5.2489 9.1634 122.9446 55.3759 45.1362 172.4849 67 M 5.5352 8.6423 120.4929 53.9485 34.4273 175.4998 68 D 5.2462 10.0356 126.3478 52.1764 41.0267 176.7701 69 T 4.3212 8.5571 107.6020 63.4264 68.6927 174.3825 70 D 4.7783 8.6444 121.3764 54.0559 41.5823 177.1131 71 G 3.3213 8.3730 108.0525 45.0871 0.0000 173.1977 72 L 4.6341 7.6996 119.7193 53.9110 43.1922 176.0917 73 L 5.2475 8.4615 122.7678 54.6984 43.1981 175.3274 74 Y 4.9085 8.9702 118.6708 56.4488 41.7365 173.0751 75 G 4.4235 9.0413 108.6281 44.8458 0.0000 173.1921 76 S 5.0451 8.9703 118.5361 56.3854 65.7210 174.6213 77 Q 3.9542 9.1160 125.7802 57.5386 29.3504 175.6688 78 T 4.4956 7.6122 107.8152 59.1294 70.6410 171.7850 79 P 3.9750 0.0000 0.0000 61.8001 31.7700 174.7003 80 N 5.1564 8.1253 121.7111 50.5074 40.1519 174.2584 81 E 3.9095 8.7806 114.7680 59.4291 29.1908 177.4980 82 E 4.1448 9.2588 118.4577 57.6473 29.8900 176.5408 83 C 5.0437 7.9261 115.4431 55.7411 41.9735 173.1620 84 L 4.5310 7.2274 120.0351 52.9873 43.3965 175.5048 85 F 5.2277 8.7299 121.5292 55.5629 43.5887 174.1429 86 L 4.8663 9.1014 122.0215 53.6739 42.8870 175.4427 87 E 4.3281 8.8996 126.8386 55.3465 30.2650 175.7945 88 R 4.7981 8.4567 125.2048 54.0484 34.6665 174.6597 89 L 4.6877 8.8388 124.4945 55.2385 43.2440 175.8326 90 E 4.6747 9.0289 124.8204 55.1840 33.5173 175.0218 91 E 3.7538 9.5828 124.6788 58.0734 27.1831 174.1075 92 N 4.3110 8.5071 110.4331 54.1135 36.6538 174.0488 93 H 4.7980 8.2931 116.7081 57.6636 37.7188 173.6284 94 Y 4.7028 7.7863 116.0145 57.7723 39.9778 173.5552 95 N 5.5906 9.5723 117.9499 51.8616 41.7080 174.3565 96 T 5.3312 8.8727 113.1881 60.0939 72.9081 172.6468 97 Y 5.0277 8.7160 119.7650 56.5957 41.1940 174.2523 98 I 4.6447 8.3076 126.0072 59.1301 39.5957 175.4799 99 S 4.1065 8.6932 122.2369 58.5085 62.4331 173.8706 100 K 3.9485 8.8298 129.5084 59.4380 32.2873 178.6286 101 K 3.7803 7.9341 118.0199 59.1485 32.3960 177.0431 102 H 5.0962 8.0714 114.9349 54.3419 29.6024 176.7845 103 A 3.9750 7.8002 124.8512 55.1827 18.5132 180.7786 104 E 3.9034 8.0131 113.1496 58.6127 29.8436 178.5461 105 K 3.9092 7.3273 117.2419 56.2961 32.5869 176.0817 106 N 4.0020 7.5915 115.2601 53.9492 36.3829 174.6214 107 W 5.0280 7.8140 117.9878 55.9506 30.8000 177.1054 108 F 5.3040 9.4660 124.2842 55.8168 40.9466 175.4890 109 V 4.1765 8.7933 121.0839 62.2208 32.5548 175.1859 110 G 4.4464 8.6307 113.3872 45.0711 0.0000 171.0296 111 L 5.1167 8.1365 120.3887 52.3641 44.8820 177.3235 112 K 4.2130 8.9367 123.6261 55.7004 32.8266 178.3104 113 K 4.0188 8.3599 119.2998 59.3114 31.9451 178.1820 114 N 4.5062 7.9262 113.9262 53.0451 38.1102 174.5694 115 G 3.7646 7.8110 108.0658 45.7916 0.0000 174.5472 116 S 4.4842 7.9729 114.3085 57.9225 63.6037 173.6038 117 C 4.7624 8.3453 117.8995 58.3446 30.4348 172.9694 118 K 4.4738 8.8849 119.9342 55.5839 33.6012 176.5111 119 R 4.2745 8.2914 120.8445 55.0689 31.6899 177.4675 120 G 3.3402 8.7142 113.6494 48.3350 0.0000 173.9395 121 P 4.2468 0.0000 0.0000 64.7075 31.3731 177.3923 122 R 4.4959 7.7180 115.3946 55.8381 29.9899 175.8850 123 T 5.3605 7.5921 107.5964 59.5974 71.4281 172.6345 124 H 4.6866 7.9291 115.4603 54.9790 30.5648 173.0313 125 Y 3.9762 8.6058 118.1319 59.7664 38.1720 175.8752 126 G 4.1638 8.9552 110.0725 45.9098 0.0000 174.5298 127 Q 4.0704 7.4978 118.4047 55.6950 28.8582 177.3272 128 K 3.8925 8.3623 119.4979 58.0025 32.8875 179.0959 129 A 3.8526 7.7215 122.0328 54.1281 18.4915 178.6034 130 I 4.5134 7.1840 106.3820 60.5017 38.6215 175.4504 131 L 4.3220 7.1376 122.7273 54.3107 42.4021 175.9869 132 F 5.4544 9.3243 122.1882 55.5691 43.5521 174.0714 133 L 5.2169 9.3415 122.5499 52.7973 45.2717 173.5350 134 P 5.1050 0.0000 0.0000 62.9020 31.9466 175.5314 135 L 5.0084 9.2438 125.5127 51.7331 44.7478 174.6488 136 P 4.6307 0.0000 0.0000 62.7149 32.3154 176.7625 137 V 3.7377 8.1879 113.4814 61.8617 31.5380 176.2455 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 4.77 0.00 3.10 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.76 4.66 0.00 3.19 3.21 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.62 5.12 0.00 3.15 3.30 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 8.93 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 8.40 4.77 0.00 2.93 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 2 N 8.40 4.68 0.00 2.98 2.80 0.00 0.00 6.91 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 8.05 4.71 0.00 1.51 1.45 0.72 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.43 0.00 2.03 2.18 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.14 0.00 5 P 0.00 4.37 0.00 2.14 2.03 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 8.79 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 7 N 7.93 4.57 0.00 2.62 2.65 0.00 0.00 5.94 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 7.91 4.84 0.00 3.04 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 9 K 7.96 4.05 0.00 1.77 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.59 7.81 10 K 7.59 4.66 0.00 1.73 1.70 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.40 7.81 11 P 0.00 4.85 0.00 2.06 2.16 0.00 3.79 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 12 K 9.15 4.70 0.00 1.95 1.97 0.00 1.37 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.64 7.81 13 L 9.21 5.12 0.00 1.62 1.59 0.46 0.61 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 14 L 8.69 4.96 0.00 1.63 1.69 0.33 0.85 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 15 Y 9.48 4.74 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 16 C 8.51 4.41 0.00 2.43 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 17 S 8.12 4.05 0.00 3.88 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 18 N 8.15 4.19 0.00 2.55 2.74 0.00 0.00 6.72 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 7.69 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 20 G 7.78 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 21 H 7.35 4.83 0.00 2.98 3.21 0.00 5.79 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.06 5.33 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.00 4.49 0.00 1.83 1.55 0.90 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.79 4.94 0.00 1.88 2.04 0.00 3.27 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 25 I 8.24 4.65 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.74 0.89 0.00 0.00 26 L 8.64 4.06 0.00 1.86 1.59 0.92 0.77 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 27 P 0.00 4.22 0.00 2.00 2.11 0.00 3.56 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 28 D 7.92 4.40 0.00 2.79 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 8.30 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.90 4.51 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 1.35 0.00 0.00 31 V 7.95 4.92 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.96 0.00 0.00 32 D 8.57 4.59 0.00 2.82 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 33 G 8.53 4.97 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 0.00 0.00 0.00 34 T 8.47 4.97 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 1.36 0.00 0.00 35 R 8.69 4.03 0.00 1.87 2.00 0.00 3.23 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 36 D 7.96 4.48 0.00 2.77 2.64 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 37 R 8.62 3.92 0.00 1.84 1.86 0.00 3.37 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.80 0.00 38 S 8.12 4.29 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 39 D 7.64 4.31 0.00 2.83 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 40 Q 8.57 4.50 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.24 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 8.86 5.01 0.00 3.35 3.40 0.00 5.75 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.64 4.61 1.88 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.96 1.05 0.00 0.00 43 Q 7.93 4.18 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 44 L 8.96 5.09 0.00 1.49 1.45 0.82 0.58 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 45 Q 9.35 4.80 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 46 L 8.82 5.59 0.00 1.64 1.31 0.90 1.08 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 47 S 8.17 4.56 0.00 3.88 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 48 A 8.30 5.15 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 49 E 9.12 3.89 0.00 1.81 1.65 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 2.27 2.41 0.00 50 S 8.40 4.71 0.00 4.07 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 51 V 8.23 3.85 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.04 0.00 0.00 52 G 9.20 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 7.85 5.11 0.00 1.77 1.70 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 2.24 2.28 0.00 54 V 8.87 4.91 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 0.64 0.00 0.00 1.19 0.00 0.00 55 Y 8.86 5.09 0.00 2.96 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 56 I 8.67 4.40 1.72 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.55 0.68 0.00 0.00 57 K 8.70 4.64 0.00 1.31 1.44 0.00 0.72 0.00 0.00 1.03 0.00 0.00 2.57 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.90 0.25 7.81 58 S 8.78 4.45 0.00 3.87 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 59 T 8.47 3.74 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 1.21 0.00 0.00 60 E 8.46 4.00 0.00 1.99 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 2.31 2.39 0.00 61 T 7.51 4.18 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 1.23 0.00 0.00 62 G 8.44 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 0.00 0.00 0.00 63 Q 7.55 4.56 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.27 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 64 Y 9.39 4.55 0.00 3.01 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 65 L 8.76 4.64 0.00 1.68 1.50 0.82 0.20 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 66 C 9.16 5.25 0.00 1.41 2.69 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 67 M 8.64 5.54 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.67 0.00 68 D 10.04 5.25 0.00 2.97 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 69 T 8.56 4.32 4.36 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 0.00 0.00 0.00 1.39 0.00 0.00 70 D 8.64 4.78 0.00 2.80 2.64 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 71 G 8.37 3.32 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 72 L 7.70 4.63 0.00 1.99 1.63 0.90 0.56 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 73 L 8.46 5.25 0.00 1.57 1.62 0.90 0.88 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 74 Y 8.97 4.91 0.00 2.94 2.99 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 75 G 9.04 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.97 5.05 0.00 4.09 3.71 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 0.00 0.00 0.00 0.00 77 Q 9.12 3.95 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.45 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 78 T 7.61 4.50 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 1.23 0.00 0.00 79 P 0.00 3.97 0.00 1.25 0.49 0.00 3.44 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.20 0.00 80 N 8.13 5.16 0.00 2.90 2.94 0.00 0.00 5.96 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 8.78 3.91 0.00 2.03 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 0.00 2.26 2.32 0.00 82 E 9.26 4.14 0.00 2.05 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 0.00 2.35 2.59 0.00 83 C 7.93 5.04 0.00 2.97 3.32 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 84 L 7.23 4.53 0.00 1.30 1.25 0.73 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.73 5.23 0.00 3.14 3.11 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 0.00 0.00 0.00 0.00 86 L 9.10 4.87 0.00 1.49 1.56 0.87 1.03 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 87 E 8.90 4.33 0.00 2.07 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 2.17 1.85 0.00 88 R 8.46 4.80 0.00 1.78 1.80 0.00 3.04 0.00 0.00 2.82 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 89 L 8.84 4.69 0.00 1.57 1.72 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.03 4.67 0.00 2.22 1.87 0.00 0.00 0.00 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 2.43 0.00 91 E 9.58 3.75 0.00 2.41 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 0.00 2.29 2.38 0.00 92 N 8.51 4.31 0.00 2.84 2.88 0.00 0.00 6.88 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 8.29 4.80 0.00 2.89 2.95 0.00 5.95 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 7.79 4.70 0.00 3.14 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 95 N 9.57 5.59 0.00 3.06 2.71 0.00 0.00 6.96 6.90 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 96 T 8.87 5.33 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 97 Y 8.72 5.03 0.00 2.73 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 98 I 8.31 4.64 1.65 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 0.65 0.49 0.00 0.00 99 S 8.69 4.11 0.00 4.11 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 0.00 100 K 8.83 3.95 0.00 1.66 1.66 0.00 1.58 0.00 0.00 1.45 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.30 7.81 101 K 7.93 3.78 0.00 1.73 1.55 0.00 1.79 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.02 1.30 7.81 102 H 8.07 5.10 0.00 3.17 2.42 0.00 5.69 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 7.80 3.97 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 8.01 3.90 0.00 1.85 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 2.18 2.15 0.00 105 K 7.33 3.91 0.00 0.96 0.87 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.49 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.01 0.92 7.81 106 N 7.59 4.00 0.00 3.00 3.12 0.00 0.00 6.93 6.97 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 0.00 107 W 7.81 5.03 0.00 3.25 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 0.00 108 F 9.47 5.30 0.00 2.84 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 0.00 109 V 8.79 4.18 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 0.65 0.00 0.00 0.58 0.00 0.00 110 G 8.63 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 0.00 111 L 8.14 5.12 0.00 1.40 1.45 1.03 0.98 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 0.00 112 K 8.94 4.21 0.00 2.03 1.69 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.49 7.81 113 K 8.36 4.02 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.44 7.81 114 N 7.93 4.51 0.00 2.80 2.90 0.00 0.00 6.29 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 7.81 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 0.00 0.00 0.00 116 S 7.97 4.48 0.00 4.02 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 0.00 117 C 8.35 4.76 0.00 3.11 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 0.00 118 K 8.88 4.47 0.00 1.61 1.73 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.37 7.81 119 R 8.29 4.27 0.00 1.60 1.60 0.00 3.07 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 120 G 8.71 3.34 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 0.00 121 P 0.00 4.25 0.00 1.87 2.16 0.00 2.95 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 1.61 1.45 0.00 122 R 7.72 4.50 0.00 1.86 1.89 0.00 3.25 0.00 0.00 3.27 7.32 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 7.59 5.36 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 1.38 0.00 0.00 124 H 7.93 4.69 0.00 3.43 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.61 3.98 0.00 3.09 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 0.00 126 G 8.96 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 0.00 0.00 0.00 0.00 127 Q 7.50 4.07 0.00 1.84 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.78 0.00 0.00 0.00 0.00 0.00 2.19 2.14 0.00 128 K 8.36 3.89 0.00 1.64 1.65 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.28 7.81 129 A 7.72 3.85 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 0.00 130 I 7.18 4.51 1.77 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.00 0.62 0.00 0.00 131 L 7.14 4.32 0.00 1.06 0.72 0.32 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.32 5.45 0.00 3.44 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 0.00 133 L 9.34 5.22 0.00 2.04 1.76 0.84 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.10 0.00 2.21 2.22 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 135 L 9.24 5.01 0.00 1.68 1.64 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.63 0.00 2.06 2.06 0.00 3.78 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 1.98 2.00 0.00 137 V 8.19 3.74 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 0.65 0.00 0.00 0.91 0.00 0.00