NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.2985 8.1844 120.9886 55.8973 42.1708 178.2202 5 M 3.5868 8.3254 119.9913 58.7076 32.3912 175.7703 6 F 4.6620 7.9526 121.9191 56.2673 39.6212 173.7878 7 D 4.7604 8.6449 125.7375 54.6572 43.2925 175.6730 8 S 5.4137 8.3125 113.9797 56.6830 66.0472 173.5288 9 I 5.0095 9.2940 124.2535 59.5081 41.0520 173.9420 10 L 4.4103 8.8836 129.9351 53.1668 43.8327 175.1516 11 V 4.4604 8.5151 127.9203 62.1826 33.2924 174.7630 12 I 5.6214 9.2574 128.1568 58.5104 40.5935 173.1692 13 C 4.5999 8.3269 123.4042 58.5040 32.8490 173.6236 14 T 4.1785 8.6968 109.5146 65.7477 68.9291 177.2981 15 G 3.3021 7.9194 108.2394 46.2074 0.0000 172.6821 16 N 4.2643 8.4048 116.6988 53.4229 37.5112 174.2764 17 I 4.4773 7.5890 108.3872 59.7815 39.0055 174.5192 18 C 4.8479 7.1436 116.3607 61.3721 31.4863 176.2013 19 R 3.8244 7.8032 118.2266 59.6740 29.8438 179.3940 20 S 3.9358 7.8103 113.4545 60.7092 63.0405 174.4787 21 P 4.1765 0.0000 0.0000 65.3128 31.0553 178.5473 22 I 3.7932 7.3393 118.1348 64.2716 37.0672 178.4538 23 G 3.4781 8.0631 106.8981 47.8346 0.0000 174.7498 24 E 3.9684 8.5061 122.5654 59.3485 29.4544 179.3939 25 R 3.9931 8.0711 117.6530 59.0237 30.0533 178.9281 26 L 4.0391 8.3623 119.3139 57.9461 41.5823 179.6955 27 L 4.1428 8.1845 118.7290 57.8262 41.0508 179.4552 28 R 3.9191 8.1444 118.3466 59.4956 29.8898 178.9154 29 R 4.1838 7.6671 113.4751 58.1213 29.8231 178.0560 30 L 4.3662 7.3242 117.9544 55.7142 43.6325 176.9200 31 L 4.8686 8.6119 118.5767 51.8990 41.8024 175.2614 32 P 4.4638 0.0000 0.0000 64.7092 31.6654 178.3709 33 S 4.4472 7.9431 110.8759 58.7056 63.7260 174.0220 34 K 4.4175 7.6304 120.8681 55.5023 33.7201 176.7249 35 K 4.3611 8.5318 124.1164 55.8708 32.8788 175.4878 36 I 5.1725 8.3761 128.3239 59.8234 39.9985 174.7313 37 N 5.3829 8.9086 123.7999 52.0884 43.4511 172.9038 38 S 5.0828 8.2195 112.4041 57.9597 66.5309 172.5260 39 A 4.5906 8.4802 120.5844 51.5261 23.2303 175.3666 40 G 4.3775 8.8874 105.7973 44.6945 0.0000 174.4799 41 V 4.2158 8.5649 115.6203 62.0257 32.2235 176.7602 42 G 4.3183 7.9472 107.8793 45.1909 0.0000 173.0729 43 A 4.3570 7.9533 120.1083 51.7959 20.1550 179.7493 44 L 4.0912 8.4783 122.0905 53.1585 40.5553 175.9907 45 V 4.0055 7.8229 123.1590 63.9174 31.9742 176.2219 46 D 4.7296 8.8628 125.9444 54.6830 39.6633 174.1228 47 H 4.5386 7.8495 116.8455 55.6423 30.0326 175.2416 48 T 4.5432 8.4196 116.3944 61.3015 68.4475 173.5843 49 A 4.3487 8.4984 125.5540 51.6289 19.1985 177.2531 50 D 4.4875 8.9638 119.8551 54.0652 42.3551 177.2742 51 E 3.8933 8.8956 125.2831 59.7261 29.6832 179.5497 52 S 3.7721 8.3347 114.8799 60.9079 62.6874 176.6022 53 A 4.0604 7.6649 123.2241 55.3363 18.2393 179.5343 54 I 3.6710 8.0356 118.7410 64.3006 37.0405 178.7060 55 R 3.7878 7.7078 119.7929 59.5027 29.7926 179.1226 56 V 3.5181 7.4481 117.1394 64.5801 31.6632 177.7232 57 A 4.0897 7.9369 121.6857 55.1697 18.2956 179.3665 58 E 4.0641 8.5720 116.3877 59.1924 29.3851 179.3548 59 K 3.8001 7.8334 119.0527 59.0232 31.9954 177.4036 60 N 4.8770 8.3258 114.9967 52.3657 38.7867 175.9374 61 G 3.9951 7.8292 107.1596 45.8902 0.0000 173.5345 62 L 4.5664 7.2838 121.2049 53.2717 43.3261 175.1644 63 C 4.7152 8.5824 125.4752 57.8658 32.7770 173.1052 64 L 4.6217 8.3032 124.7669 54.0392 42.2832 176.4002 65 K 3.7857 7.8525 118.4884 58.3321 32.3337 177.1569 66 G 3.9825 8.8736 110.3602 45.2425 0.0000 173.2203 67 H 4.4645 7.4534 119.0916 56.1124 30.7380 174.6456 68 R 4.4765 7.8952 123.9711 54.1140 32.9765 174.7483 69 G 3.9060 9.2215 114.2569 47.5723 0.0000 172.1667 70 T 5.0265 9.4426 120.9291 61.4115 72.6888 173.1158 71 K 4.5531 8.7172 128.0370 55.8348 33.0458 176.1664 72 F 4.4943 9.1966 131.4506 58.5631 40.0003 174.4286 73 T 4.4093 7.3875 114.4225 58.5666 72.0462 174.8383 74 S 3.8647 8.3256 117.3446 61.4674 62.6871 176.3987 75 A 3.9289 7.7048 123.1247 54.8911 18.4591 178.8931 76 L 4.0536 7.7967 118.6376 58.1149 42.1899 178.7925 77 A 4.2360 7.9199 120.8287 55.4614 18.0499 179.6478 78 R 4.0921 7.7198 114.8556 58.4865 30.1522 178.0467 79 Q 4.2445 7.7897 116.4266 55.0850 29.3206 174.8889 80 Y 4.7397 7.3918 117.4980 56.2749 41.4251 175.2930 81 D 4.7708 8.8820 122.4255 56.1038 42.2308 176.5652 82 L 4.8848 8.2128 120.2066 53.3175 45.9052 174.7853 83 L 5.1000 8.8322 126.0291 52.9006 44.5714 175.2118 84 L 5.0352 8.6149 123.8446 53.1328 44.2260 176.0852 85 V 4.6933 8.5502 117.6680 59.8944 34.3359 177.1858 86 M 4.1162 8.6360 123.0114 57.8385 32.9779 176.6357 87 E 4.9936 8.1474 116.4000 54.0189 33.2481 176.1855 88 Y 4.0804 8.7610 120.0266 61.6784 37.8500 179.8233 89 S 4.2438 8.1280 113.9870 61.5390 63.1171 175.9992 90 H 4.7698 7.9822 121.3627 57.8948 28.2786 177.5595 91 L 3.9487 7.7687 121.2035 57.9827 41.6339 179.3610 92 E 3.9955 8.1415 117.8082 59.5540 29.5088 179.3178 93 Q 4.0500 7.8863 118.2025 59.1057 28.6898 178.9660 94 I 3.8791 7.9458 120.7020 63.9864 36.8827 178.6344 95 S 4.1462 7.9806 116.7306 61.6354 62.5173 176.7274 96 R 4.1270 7.6690 116.3527 58.6061 29.6370 178.5762 97 I 4.0531 7.9852 119.9900 63.0052 38.8359 176.5140 98 A 4.7517 8.2343 121.9574 49.3396 18.7508 174.4960 99 P 4.6185 0.0000 0.0000 63.9916 32.0569 178.4631 100 E 4.2785 8.1923 114.9974 57.2807 30.0042 176.6457 101 A 4.6223 8.2106 121.8028 51.8238 19.5354 178.7610 102 R 3.9557 7.7783 116.4796 58.9661 30.2589 178.3521 103 G 3.8572 8.0950 104.8202 46.4985 0.0000 173.8638 104 K 4.6112 8.1306 118.7275 56.6021 33.0395 174.8849 105 T 4.9773 7.4630 115.6188 62.8338 69.9643 173.8857 106 M 4.8806 9.2380 124.7650 53.2152 37.6367 174.3093 107 L 4.4383 8.2616 119.8180 54.7536 42.3960 178.0647 108 F 3.9722 9.4282 127.1167 60.4988 40.1341 176.2639 109 G 4.3754 7.9763 106.0478 44.8392 0.0000 175.1993 110 H 3.7208 7.9553 121.8451 58.4155 29.8110 175.8410 111 W 4.4973 7.3828 115.5555 56.6425 29.0708 175.9318 112 L 4.5374 7.2151 119.0355 53.4394 42.8652 176.7475 113 D 4.3001 8.6456 119.2022 57.3320 40.7116 177.5293 114 S 4.5717 7.7253 118.1725 56.3510 61.6405 174.1830 115 K 4.7801 8.4534 127.6686 58.6465 32.2147 177.4312 116 E 4.1451 7.4964 116.6904 56.1983 30.2807 176.7039 117 I 4.3026 8.3497 128.4782 59.1362 37.7347 173.9972 118 P 4.3452 0.0000 0.0000 62.4631 32.1542 176.0848 119 D 4.4048 8.6103 123.1448 53.4966 41.3829 174.2077 120 P 4.3099 0.0000 0.0000 62.3886 32.1884 174.7500 121 Y 4.5225 8.1124 121.1137 59.8998 38.7553 176.6597 122 R 3.7922 8.7040 124.0264 56.6926 27.9120 175.9068 123 M 4.4448 8.0694 118.7734 53.8328 34.0431 176.1432 124 S 4.5465 8.2646 114.6253 58.1814 65.3601 174.5993 125 D 4.4567 8.6182 121.6044 57.7537 40.6440 178.8502 126 E 3.9496 8.3536 118.2496 59.4408 29.4843 179.2397 127 A 4.0216 7.9343 120.2507 55.2400 18.3914 179.7485 128 F 4.0117 8.5542 116.3726 60.5915 38.9917 177.4723 129 D 4.4487 8.9992 119.1126 57.6351 40.6968 179.0267 130 S 4.1454 8.0438 113.0288 61.3871 62.3539 176.3223 131 V 3.5846 7.7878 120.9448 66.0560 31.1633 177.2879 132 Y 3.9721 8.4331 119.6248 60.7396 38.5671 177.9133 133 Q 4.0648 8.2166 119.9715 59.1295 29.1000 178.1995 134 L 4.0090 7.9120 119.8778 57.9384 41.6467 179.3976 135 L 4.1319 8.1743 119.1850 57.8578 41.5264 179.3897 136 E 3.8420 8.2401 119.2223 59.3419 29.6163 178.7225 137 Q 4.0129 8.4546 118.2833 59.0125 28.7510 178.9377 138 A 4.0255 8.4870 121.9846 55.2980 18.4722 179.7489 139 S 4.0998 8.5314 113.9846 61.6825 63.0381 177.0841 140 K 3.9221 8.1801 120.9438 59.6343 31.9769 179.3488 141 R 3.7425 7.8576 118.1297 59.2366 30.0180 179.1684 142 W 4.1344 8.2817 118.2917 59.7280 29.0057 178.4043 143 A 4.1091 8.6410 121.4365 55.0338 17.5514 179.3281 144 E 3.9744 7.8465 114.8867 59.0137 30.0293 178.9876 145 K 3.9100 7.6601 118.4912 58.4282 32.1380 178.3939 146 L 4.6474 7.9949 117.8682 55.6067 42.4001 176.8215 147 G 3.7675 8.1388 112.0706 45.6826 0.0000 173.3030 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 4 L 8.18 4.30 0.00 1.76 1.83 0.90 0.28 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 5 M 8.33 3.59 0.00 1.11 1.86 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.21 0.00 6 F 7.95 4.66 0.00 3.12 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 7 D 8.64 4.76 0.00 2.72 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 8 S 8.31 5.41 0.00 3.95 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 9 I 9.29 5.01 1.87 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 1.06 0.86 0.79 0.00 0.00 10 L 8.88 4.41 0.00 0.62 1.29 0.50 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.52 4.46 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 0.78 0.00 0.00 0.99 0.00 0.00 12 I 9.26 5.62 1.60 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.27 0.53 0.00 0.00 13 C 8.33 4.60 0.00 2.83 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 14 T 8.70 4.18 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 1.19 0.00 0.00 15 G 7.92 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.40 4.26 0.00 2.83 2.85 0.00 0.00 7.12 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 17 I 7.59 4.48 1.96 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.50 1.00 0.00 0.00 18 C 7.14 4.85 0.00 2.99 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 19 R 7.80 3.82 0.00 1.71 1.76 0.00 3.03 0.00 0.00 3.56 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 20 S 7.81 3.94 0.00 4.02 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 21 P 0.00 4.18 0.00 2.06 1.75 0.00 3.64 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 2.05 2.03 0.00 22 I 7.34 3.79 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.76 0.87 0.00 0.00 23 G 8.06 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 24 E 8.51 3.97 0.00 2.03 2.26 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 2.34 2.40 0.00 25 R 8.07 3.99 0.00 1.92 2.00 0.00 3.39 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.03 0.00 26 L 8.36 4.04 0.00 1.93 1.77 0.63 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.18 4.14 0.00 1.91 1.75 0.89 0.84 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 28 R 8.14 3.92 0.00 2.06 2.04 0.00 3.15 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 29 R 7.67 4.18 0.00 1.94 2.09 0.00 3.10 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.70 0.00 30 L 7.32 4.37 0.00 1.87 1.79 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.61 4.87 0.00 1.64 1.58 0.97 0.40 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 32 P 0.00 4.46 0.00 2.19 2.22 0.00 3.48 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 33 S 7.94 4.45 0.00 4.01 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 34 K 7.63 4.42 0.00 1.84 1.92 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.42 7.81 35 K 8.53 4.36 0.00 1.89 1.76 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.71 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.49 1.44 7.81 36 I 8.38 5.17 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.84 0.97 0.00 0.00 37 N 8.91 5.38 0.00 2.58 2.68 0.00 0.00 6.07 7.45 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 38 S 8.22 5.08 0.00 3.84 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 39 A 8.48 4.59 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 40 G 8.89 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 0.00 0.00 0.00 0.00 41 V 8.56 4.22 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 0.47 0.00 0.00 0.92 0.00 0.00 42 G 7.95 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 43 A 7.95 4.36 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 44 L 8.48 4.09 0.00 1.62 1.24 0.83 0.70 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 45 V 7.82 4.01 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 0.79 0.00 0.00 0.97 0.00 0.00 46 D 8.86 4.73 0.00 2.95 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 47 H 7.85 4.54 0.00 3.30 3.23 0.00 5.63 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 48 T 8.42 4.54 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 49 A 8.50 4.35 1.23 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 50 D 8.96 4.49 0.00 2.93 2.70 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 51 E 8.90 3.89 0.00 2.05 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 2.32 2.38 0.00 52 S 8.33 3.77 0.00 2.90 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.66 4.06 1.48 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 54 I 8.04 3.67 1.97 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 1.41 0.66 0.89 0.00 0.00 55 R 7.71 3.79 0.00 1.87 1.92 0.00 3.26 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 56 V 7.45 3.52 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 1.06 0.00 0.00 0.92 0.00 0.00 57 A 7.94 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.57 4.06 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 59 K 7.83 3.80 0.00 1.92 1.83 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.45 7.81 60 N 8.33 4.88 0.00 2.27 2.69 0.00 0.00 6.88 8.33 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 61 G 7.83 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 0.00 0.00 0.00 62 L 7.28 4.57 0.00 1.77 1.86 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.58 4.72 0.00 2.97 2.82 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 64 L 8.30 4.62 0.00 1.74 1.65 0.94 0.92 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 65 K 7.85 3.79 0.00 1.76 1.79 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.48 7.81 66 G 8.87 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 67 H 7.45 4.46 0.00 3.30 3.24 0.00 5.90 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.90 4.48 0.00 1.75 1.66 0.00 3.29 0.00 0.00 3.41 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.59 0.00 69 G 9.22 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 70 T 9.44 5.03 4.37 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 1.21 0.00 0.00 71 K 8.72 4.55 0.00 1.75 1.70 0.00 1.92 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.50 7.81 72 F 9.20 4.49 0.00 2.94 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 73 T 7.39 4.41 4.07 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 1.15 0.00 0.00 74 S 8.33 3.86 0.00 4.03 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.70 3.93 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 76 L 7.80 4.05 0.00 1.73 1.65 1.14 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.92 4.24 1.50 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 78 R 7.72 4.09 0.00 1.94 2.00 0.00 3.15 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 79 Q 7.79 4.24 0.00 1.94 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.62 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 80 Y 7.39 4.74 0.00 3.02 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 81 D 8.88 4.77 0.00 2.86 2.85 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 82 L 8.21 4.88 0.00 1.68 1.40 0.49 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.83 5.10 0.00 1.61 1.43 1.03 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.61 5.04 0.00 1.56 1.54 -0.18 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.55 4.69 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 0.51 0.00 0.00 0.91 0.00 0.00 86 M 8.64 4.12 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.71 0.00 87 E 8.15 4.99 0.00 1.71 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 2.24 2.24 0.00 88 Y 8.76 4.08 0.00 3.00 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 89 S 8.13 4.24 0.00 4.02 4.12 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 90 H 7.98 4.77 0.00 3.35 3.25 0.00 5.65 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 91 L 7.77 3.95 0.00 1.86 1.73 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.14 4.00 0.00 1.98 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 2.42 2.36 0.00 93 Q 7.89 4.05 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 94 I 7.95 3.88 1.90 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.50 0.92 0.00 0.00 95 S 7.98 4.15 0.00 4.05 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 96 R 7.67 4.13 0.00 2.02 2.07 0.00 3.08 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 97 I 7.99 4.05 2.21 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.70 1.08 0.00 0.00 98 A 8.23 4.75 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.62 0.00 2.21 2.15 0.00 3.90 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 2.14 2.25 0.00 100 E 8.19 4.28 0.00 1.98 2.02 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 2.31 2.32 0.00 101 A 8.21 4.62 1.40 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 0.00 0.00 102 R 7.78 3.96 0.00 1.98 2.03 0.00 3.14 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 103 G 8.09 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 0.00 0.00 0.00 104 K 8.13 4.61 0.00 2.21 2.09 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.54 7.81 105 T 7.46 4.98 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 1.12 0.00 0.00 106 M 9.24 4.88 0.00 1.81 1.85 0.00 0.00 0.00 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 107 L 8.26 4.44 0.00 1.51 1.49 0.32 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.43 3.97 0.00 3.05 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 0.00 109 G 7.98 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 0.00 0.00 0.00 0.00 110 H 7.96 3.72 0.00 3.08 2.48 0.00 5.94 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 7.38 4.50 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 0.00 112 L 7.22 4.54 0.00 1.73 1.62 0.98 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.65 4.30 0.00 2.67 2.72 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 0.00 114 S 7.73 4.57 0.00 3.87 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 0.00 115 K 8.45 4.78 0.00 1.76 1.65 0.00 1.98 0.00 0.00 1.52 0.00 0.00 2.77 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.66 1.35 7.81 116 E 7.50 4.15 0.00 2.17 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 2.36 2.30 0.00 117 I 8.35 4.30 1.82 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.03 0.84 0.00 0.00 118 P 0.00 4.35 0.00 1.89 1.97 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 119 D 8.61 4.40 0.00 2.80 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 0.00 120 P 0.00 4.31 0.00 0.49 1.69 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 121 Y 8.11 4.52 0.00 2.88 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 0.00 122 R 8.70 3.79 0.00 1.85 1.92 0.00 3.07 0.00 0.00 3.05 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.00 123 M 8.07 4.44 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 124 S 8.26 4.55 0.00 4.23 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 0.00 125 D 8.62 4.46 0.00 2.72 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 0.00 126 E 8.35 3.95 0.00 2.09 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 2.42 2.47 0.00 127 A 7.93 4.02 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 0.00 128 F 8.55 4.01 0.00 3.21 3.17 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 0.00 129 D 9.00 4.45 0.00 2.91 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 0.00 130 S 8.04 4.15 0.00 3.96 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 0.00 131 V 7.79 3.58 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 0.95 0.00 0.00 0.95 0.00 0.00 132 Y 8.43 3.97 0.00 3.29 3.17 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 0.00 133 Q 8.22 4.06 0.00 2.35 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 134 L 7.91 4.01 0.00 1.96 1.74 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.17 4.13 0.00 1.63 1.60 0.82 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.24 3.84 0.00 1.79 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 2.32 2.33 0.00 137 Q 8.45 4.01 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 138 A 8.49 4.03 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 0.00 139 S 8.53 4.10 0.00 4.09 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 0.00 140 K 8.18 3.92 0.00 2.00 1.85 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.56 7.81 141 R 7.86 3.74 0.00 1.90 1.70 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 142 W 8.28 4.13 0.00 3.39 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 0.00 143 A 8.64 4.11 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 7.85 3.97 0.00 2.08 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 2.20 2.09 0.00 145 K 7.66 3.91 0.00 1.67 1.67 0.00 0.81 0.00 0.00 1.17 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 0.21 7.81 146 L 7.99 4.65 0.00 1.73 1.84 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.14 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 0.00 0.00 0.00