NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7183 8.1627 120.6177 55.4891 34.1894 173.4383 2 R 4.9046 8.8662 126.4214 53.6679 32.7938 169.1741 3 V 4.8647 9.0439 126.4635 60.9488 35.2895 173.3241 4 L 5.0209 9.4280 129.5502 53.4311 44.9319 174.7954 5 L 5.0873 9.3881 128.1490 53.3402 43.7434 175.7671 6 I 4.8837 8.9153 125.9096 59.5280 39.9609 174.5967 7 H 4.7703 9.1678 129.3811 56.1431 30.6071 174.3489 8 S 5.1512 9.0160 121.6376 56.7724 66.6564 175.0965 9 D 4.5276 9.0717 122.8051 57.5595 41.7543 175.7779 10 Y 5.3070 7.0079 114.0792 56.3654 41.6293 173.4685 11 I 4.9429 8.9909 119.9412 59.6204 41.5156 173.2637 12 E 5.3181 9.6509 129.8581 54.7079 33.6055 173.7156 13 Y 5.6486 8.3164 121.2154 55.5291 42.4535 173.3409 14 E 5.0845 9.5698 121.8685 54.1188 32.6118 175.1455 15 V 4.1312 9.7408 129.0542 62.6471 32.1773 174.1987 16 K 4.6922 9.2124 125.2232 56.8578 34.1371 179.8349 17 D 4.8742 9.4079 133.6584 55.3796 42.3141 174.5497 18 K 4.4317 8.6703 123.3351 55.1013 32.1669 176.8457 19 A 4.0569 8.7464 125.8891 50.7939 20.0408 176.5525 20 L 4.7076 7.1750 113.9621 51.9328 45.3817 176.7850 21 K 4.0376 8.6322 119.7430 59.4627 33.1315 177.7576 22 N 4.9296 7.6178 116.5252 51.3891 38.3786 172.9584 23 P 4.3203 0.0000 0.0000 62.2282 32.7487 177.1705 24 E 4.0573 8.4021 122.5329 56.3552 29.8799 175.1638 25 P 4.6776 0.0000 0.0000 63.0969 31.9967 175.7585 26 I 4.5970 8.1890 115.0852 58.9175 40.7553 175.2971 27 S 4.4825 8.3151 117.4982 57.3480 64.5068 174.6920 28 E 3.9192 8.7527 120.7677 59.6284 29.1005 178.3454 29 D 4.5058 8.1115 116.5220 56.6258 40.9777 177.3594 30 M 4.4476 7.5973 117.1713 55.7714 32.6193 177.7189 31 K 4.1003 7.9037 119.2503 58.0613 32.3167 176.6506 32 R 4.7064 6.6640 115.1329 53.3153 34.0828 175.1116 33 G 4.0688 7.0886 107.0872 45.6184 0.0000 171.5091 34 R 5.1933 8.2226 118.5045 55.5121 33.1913 173.7769 35 M 5.0206 9.2107 125.4139 54.1597 35.9237 173.5124 36 E 4.9391 9.0130 123.6351 55.1752 32.1284 175.2083 37 E 3.9263 8.5006 119.6045 56.9634 27.0801 174.4812 38 V 4.7391 8.4769 118.9016 59.9927 35.9633 175.5952 39 L 4.4755 9.2618 127.9003 54.4309 42.9463 175.4874 40 V 4.3390 8.7750 128.3047 62.0025 32.9252 174.7334 41 A 4.9531 8.8520 131.4167 50.4764 20.0150 175.2497 42 F 4.9035 8.8481 121.1947 58.0456 40.6446 175.2688 43 I 5.1432 8.9311 124.1526 59.7168 41.1484 174.4087 44 S 4.9921 9.1063 123.7075 56.6639 65.0897 173.6607 45 V 4.2029 8.4809 125.8658 62.7328 32.6999 175.3913 46 E 4.9549 9.6541 127.8517 54.6696 31.4933 177.0300 47 K 3.9041 8.9854 122.1374 59.7537 32.2090 179.0898 48 V 3.6238 7.9235 118.8745 65.4141 30.9794 177.9232 49 D 4.3840 7.9818 119.0537 56.9458 40.4048 178.3580 50 E 4.0597 7.9814 120.6905 60.0320 29.7181 179.9988 51 K 4.3049 7.9867 123.4924 58.8676 32.7737 180.8844 52 N 5.7262 8.2743 116.2669 50.5840 40.9351 172.3015 53 P 4.2439 0.0000 0.0000 65.3799 31.7255 177.3460 54 E 3.9193 8.0589 117.2668 59.0727 29.6453 178.1840 55 E 3.9023 8.2825 119.1420 59.6097 29.7852 179.3484 56 V 3.6563 7.5623 112.4414 64.2148 31.4649 178.8185 57 S 4.0744 7.9883 114.7199 61.5558 62.7632 176.3730 58 L 3.9666 8.2039 121.8862 58.0618 41.4784 179.8262 59 K 3.9375 8.2382 117.8824 59.5693 31.9968 179.2916 60 A 4.0327 8.4459 121.3297 55.0812 18.1689 179.5591 61 I 3.5589 8.1867 118.8128 64.4436 37.1073 177.7919 62 E 3.9299 8.2560 119.8657 59.7223 29.2910 178.9851 63 E 3.9801 8.2308 118.0385 59.6759 29.5878 179.5724 64 I 3.7551 7.7501 119.7004 64.2561 37.2903 178.6365 65 S 4.0196 8.3041 116.3103 61.4150 62.7124 176.8741 66 K 4.0940 7.7864 121.4798 59.2405 31.7350 179.6098 67 V 3.6316 7.6375 118.5399 65.6740 31.3909 177.9349 68 A 3.9464 7.9919 120.6898 55.2771 18.1871 179.5179 69 E 4.0647 8.3210 116.9135 58.9672 29.3772 178.5355 70 Q 4.4996 7.8236 114.5778 56.8065 29.2703 177.0706 71 V 4.2420 7.2195 112.8746 60.0135 32.5372 175.1463 72 K 3.7858 7.4361 116.7471 57.0905 31.0658 174.6856 73 A 4.3272 8.2122 122.9225 51.9650 18.8830 179.0147 74 E 4.5638 8.9330 121.0545 57.9339 31.5791 172.1761 75 N 5.6743 8.2342 115.4614 52.1163 41.4821 174.0132 76 V 4.9137 8.7999 122.3975 61.0813 35.7334 174.0837 77 F 5.0389 9.0272 127.5657 56.5226 42.8099 173.5117 78 V 4.1728 8.5791 127.8803 62.3907 32.8736 174.0343 79 Y 4.5540 8.9375 130.2319 54.9313 40.8264 172.8081 80 P 4.7370 0.0000 0.0000 62.9707 32.2842 177.1963 81 F 4.9476 9.3010 126.4254 56.3110 40.4453 174.5427 82 A 4.0652 8.4190 124.2345 53.7179 18.4753 177.9411 83 H 4.6335 7.4722 112.0425 55.7008 29.0281 175.9270 84 L 4.4307 7.8474 119.0845 55.6351 41.9335 176.2442 85 S 4.6370 7.5815 111.5549 57.2635 65.2878 173.0230 86 S 4.6022 8.5800 116.8833 58.4429 63.7645 174.1627 87 E 4.6054 7.7770 120.7048 54.6162 28.4844 173.9613 88 L 4.7244 7.8884 123.3950 53.7308 43.6366 175.9499 89 A 4.6095 8.7887 128.2666 51.1691 19.6184 177.4259 90 K 4.1330 9.2696 119.5338 55.8578 33.6546 176.3105 91 P 4.5259 0.0000 0.0000 66.5849 31.0126 178.5991 92 S 3.9164 8.0998 114.0137 60.7850 62.7529 176.4914 93 V 3.4735 7.6851 121.0616 65.5510 31.4437 177.5731 94 A 3.9568 8.0676 120.6074 55.3484 18.0983 179.2901 95 M 2.9645 8.1428 116.9818 58.4851 32.2114 177.3874 96 D 4.3135 7.6115 117.9152 58.0016 41.2918 178.7867 97 I 3.7127 7.9216 119.7789 64.3716 37.1523 178.5655 98 L 4.0534 8.0084 119.8425 57.5653 41.3576 179.1404 99 N 4.3739 7.8926 117.3798 56.5868 38.9572 177.2346 100 R 3.9094 7.9499 119.5444 59.1827 30.1451 179.0482 101 V 3.5657 7.8278 117.9840 66.1837 31.5198 177.4047 102 Y 3.9939 7.9499 118.9132 60.9197 38.7686 177.7856 103 Q 3.8481 8.8723 120.9066 58.8899 28.8687 178.4037 104 G 3.6181 8.1551 106.5137 47.8213 0.0000 175.4028 105 L 4.2380 8.0347 121.6217 57.3485 41.6297 179.6351 106 K 3.8808 7.8531 118.4577 59.6117 31.7669 179.2185 107 E 4.0323 8.0242 117.3244 58.8884 29.4136 178.8331 108 R 4.1909 7.4822 116.5858 56.5740 30.5053 177.2530 109 G 3.9048 7.8876 106.5288 44.7957 0.0000 174.0322 110 F 4.4016 7.6428 117.5539 57.3526 40.3933 174.6374 111 N 4.7167 9.1203 120.0000 52.8100 39.5900 173.6971 112 V 4.8644 8.4334 126.8077 61.1643 33.5052 175.1691 113 G 4.2801 8.9291 115.2203 44.7309 0.0000 172.0567 114 K 4.6702 7.9386 117.1199 54.7666 35.5131 175.0655 115 A 4.2374 7.7195 123.1682 48.8968 20.9281 174.8837 116 P 4.4155 0.0000 0.0000 63.5360 31.7882 175.5150 117 F 4.1986 9.4099 125.4485 58.5868 40.8261 176.1006 118 G 3.5288 8.5800 113.3125 45.0112 0.0000 171.7977 119 Y 4.9914 7.0740 114.7054 55.7879 42.0347 174.7774 120 Y 4.6403 8.6081 120.1370 58.0662 39.3028 174.9529 121 K 5.4188 8.8505 121.6188 54.5066 36.3069 176.0094 122 A 4.5725 9.1179 126.5225 52.0987 19.6032 176.4514 123 F 5.6362 8.4951 114.9122 55.3965 41.4061 173.7891 124 K 4.7837 9.3949 120.1577 54.8354 35.0820 175.0448 125 I 4.9619 8.3808 122.6379 59.4009 41.8862 174.5294 126 S 4.3019 7.7378 121.7086 56.1719 64.5027 172.2700 127 C 4.6298 8.4377 128.1373 58.9703 31.3790 173.9373 128 K 3.8437 8.7496 126.2288 57.5845 31.8189 178.2029 129 G 3.8347 8.0870 105.0833 46.3915 0.0000 173.3250 130 H 4.5965 7.5271 116.3328 54.2474 29.5570 174.4662 131 P 4.2100 0.0000 0.0000 65.6282 31.1378 177.4879 132 L 4.5323 7.8512 114.2969 54.4974 41.8323 176.9633 133 A 4.2849 8.0951 123.3083 53.4974 18.8841 177.4130 134 E 5.0591 7.9061 114.1561 54.7325 32.6989 174.9872 135 L 5.0498 9.0073 124.2650 52.9158 46.4442 175.9280 136 S 5.2964 8.6265 115.0891 56.8783 66.3476 173.3731 137 R 4.7371 8.8126 119.3713 54.9900 34.7322 174.0842 138 T 4.9348 8.5892 119.1710 62.0789 70.2424 173.9010 139 I 4.5403 8.8555 128.2332 59.5993 39.3442 175.7687 140 V 4.5299 8.2713 119.6549 58.4479 34.9678 173.8943 141 P 4.3640 0.0000 0.0000 63.3812 31.6540 177.4488 142 E 4.2505 9.4211 121.2794 58.1429 30.2067 175.0025 143 E 4.7787 7.7245 110.2817 54.9178 33.9760 180.4639 144 A 4.5415 8.4695 124.1843 51.5140 19.1187 177.6752 145 R 4.1122 8.5891 120.3754 56.9254 30.6941 177.8734 146 V 4.0059 8.1167 117.5213 61.6593 31.4910 176.4805 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.72 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 2 R 8.87 4.90 0.00 1.99 1.80 0.00 3.35 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.74 0.00 3 V 9.04 4.86 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 0.92 0.00 0.00 0.97 0.00 0.00 4 L 9.43 5.02 0.00 1.75 1.56 0.97 0.25 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 5 L 9.39 5.09 0.00 1.60 1.57 0.91 0.16 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 6 I 8.92 4.88 2.01 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 1.33 1.18 0.93 0.00 0.00 7 H 9.17 4.77 0.00 3.23 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 9.02 5.15 0.00 3.79 3.74 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 9 D 9.07 4.53 0.00 2.34 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 10 Y 7.01 5.31 0.00 3.03 3.04 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 11 I 8.99 4.94 1.66 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 1.02 0.47 0.00 0.00 12 E 9.65 5.32 0.00 2.06 1.81 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 2.17 2.28 0.00 13 Y 8.32 5.65 0.00 3.44 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.57 5.08 0.00 2.02 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 2.24 2.23 0.00 15 V 9.74 4.13 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 0.53 0.00 0.00 0.94 0.00 0.00 16 K 9.21 4.69 0.00 1.90 0.89 0.00 1.83 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.64 7.81 17 D 9.41 4.87 0.00 2.97 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.67 4.43 0.00 1.54 1.59 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.01 7.81 19 A 8.75 4.06 0.13 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 0.00 0.00 20 L 7.17 4.71 0.00 1.36 1.49 0.79 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.63 4.04 0.00 1.83 1.92 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.43 7.81 22 N 7.62 4.93 0.00 2.71 2.82 0.00 0.00 6.91 8.02 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 23 P 0.00 4.32 0.00 1.38 1.39 0.00 3.81 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.64 0.00 24 E 8.40 4.06 0.00 2.21 2.28 0.00 0.00 0.00 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 2.33 0.00 25 P 0.00 4.68 0.00 2.14 2.08 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 26 I 8.19 4.60 1.77 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.65 0.86 0.00 0.00 27 S 8.32 4.48 0.00 4.03 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 28 E 8.75 3.92 0.00 2.10 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 2.38 2.46 0.00 29 D 8.11 4.51 0.00 2.69 2.73 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 30 M 7.60 4.45 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 31 K 7.90 4.10 0.00 1.87 1.87 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.45 7.81 32 R 6.66 4.71 0.00 1.53 1.60 0.00 3.24 0.00 0.00 3.83 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 33 G 7.09 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 0.00 0.00 0.00 0.00 34 R 8.22 5.19 0.00 1.73 1.73 0.00 3.22 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 35 M 9.21 5.02 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.63 0.00 36 E 9.01 4.94 0.00 2.18 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 2.26 2.38 0.00 37 E 8.50 3.93 0.00 2.19 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 0.00 2.30 2.42 0.00 38 V 8.48 4.74 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.09 0.00 0.00 39 L 9.26 4.48 0.00 1.71 1.55 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.77 4.34 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 -0.11 0.00 0.00 0.87 0.00 0.00 41 A 8.85 4.95 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 42 F 8.85 4.90 0.00 2.85 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 43 I 8.93 5.14 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.36 0.98 0.00 0.00 44 S 9.11 4.99 0.00 3.82 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 45 V 8.48 4.20 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 1.02 0.00 0.00 1.03 0.00 0.00 46 E 9.65 4.95 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 47 K 8.99 3.90 0.00 1.84 1.82 0.00 1.55 0.00 0.00 1.85 0.00 0.00 3.28 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.51 7.81 48 V 7.92 3.62 2.09 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 0.78 0.00 0.00 0.94 0.00 0.00 49 D 7.98 4.38 0.00 2.86 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 50 E 7.98 4.06 0.00 2.02 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 2.35 2.36 0.00 51 K 7.99 4.30 0.00 1.80 1.82 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 52 N 8.27 5.73 0.00 2.78 2.66 0.00 0.00 7.09 7.01 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 53 P 0.00 4.24 0.00 2.18 2.09 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 54 E 8.06 3.92 0.00 2.07 1.93 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 2.37 2.42 0.00 55 E 8.28 3.90 0.00 2.23 1.93 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 2.31 2.36 0.00 56 V 7.56 3.66 2.09 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 0.77 0.00 0.00 1.03 0.00 0.00 57 S 7.99 4.07 0.00 4.12 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 58 L 8.20 3.97 0.00 1.96 1.73 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.24 3.94 0.00 2.02 1.87 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.47 1.47 7.81 60 A 8.45 4.03 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 61 I 8.19 3.56 2.04 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 1.54 0.74 0.93 0.00 0.00 62 E 8.26 3.93 0.00 2.10 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 0.00 2.33 2.44 0.00 63 E 8.23 3.98 0.00 2.11 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 2.50 2.51 0.00 64 I 7.75 3.76 1.89 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 1.49 0.86 0.77 0.00 0.00 65 S 8.30 4.02 0.00 4.13 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 0.00 66 K 7.79 4.09 0.00 1.94 1.86 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.72 7.81 67 V 7.64 3.63 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 0.98 0.00 0.00 0.97 0.00 0.00 68 A 7.99 3.95 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 69 E 8.32 4.06 0.00 2.14 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 0.00 2.40 2.56 0.00 70 Q 7.82 4.50 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 71 V 7.22 4.24 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 0.83 0.00 0.00 0.77 0.00 0.00 72 K 7.44 3.79 0.00 1.93 1.89 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.44 7.81 73 A 8.21 4.33 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 74 E 8.93 4.56 0.00 1.67 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 0.00 2.29 1.91 0.00 75 N 8.23 5.67 0.00 2.98 2.83 0.00 0.00 6.54 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 76 V 8.80 4.91 1.95 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 0.87 0.00 0.00 0.46 0.00 0.00 77 F 9.03 5.04 0.00 3.21 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.58 4.17 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 0.87 0.00 0.00 1.01 0.00 0.00 79 Y 8.94 4.55 0.00 2.92 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 0.00 0.00 0.00 80 P 0.00 4.74 0.00 1.98 2.18 0.00 3.32 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 81 F 9.30 4.95 0.00 3.62 3.08 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 0.00 82 A 8.42 4.07 1.08 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 0.00 0.00 0.00 83 H 7.47 4.63 0.00 2.61 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.85 4.43 0.00 1.80 1.81 1.08 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.58 4.64 0.00 3.87 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 86 S 8.58 4.60 0.00 3.86 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 87 E 7.78 4.61 0.00 1.95 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 2.24 2.37 0.00 88 L 7.89 4.72 0.00 1.65 1.55 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.79 4.61 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 90 K 9.27 4.13 0.00 1.95 1.96 0.00 1.35 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.37 7.81 91 P 0.00 4.53 0.00 2.41 2.56 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 92 S 8.10 3.92 0.00 4.02 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 0.00 93 V 7.69 3.47 2.24 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 1.10 0.00 0.00 0.92 0.00 0.00 94 A 8.07 3.96 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 95 M 8.14 2.96 0.00 1.71 0.85 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 96 D 7.61 4.31 0.00 2.88 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 97 I 7.92 3.71 1.85 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 1.50 0.95 0.91 0.00 0.00 98 L 8.01 4.05 0.00 1.93 1.66 0.99 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 99 N 7.89 4.37 0.00 2.81 2.93 0.00 0.00 7.12 7.51 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 0.00 100 R 7.95 3.91 0.00 1.91 1.96 0.00 3.18 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 101 V 7.83 3.57 2.25 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 1.01 0.00 0.00 0.96 0.00 0.00 102 Y 7.95 3.99 0.00 3.16 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 0.00 103 Q 8.87 3.85 0.00 2.41 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 104 G 8.16 3.62 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 0.00 0.00 0.00 105 L 8.03 4.24 0.00 1.75 1.68 0.85 0.44 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 0.00 106 K 7.85 3.88 0.00 1.78 1.73 0.00 1.31 0.00 0.00 1.28 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 0.92 7.81 107 E 8.02 4.03 0.00 2.13 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 2.32 2.41 0.00 108 R 7.48 4.19 0.00 2.15 2.00 0.00 3.35 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 109 G 7.89 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 110 F 7.64 4.40 0.00 3.07 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 0.00 111 N 9.12 4.72 0.00 2.92 2.80 0.00 0.00 7.03 7.13 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 0.00 112 V 8.43 4.86 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 0.82 0.00 0.00 0.91 0.00 0.00 113 G 8.93 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.94 4.67 0.00 1.16 0.98 0.00 0.61 0.00 0.00 0.71 0.00 0.00 2.61 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.71 0.85 7.81 115 A 7.72 4.24 0.24 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 0.00 116 P 0.00 4.42 0.00 1.92 1.97 0.00 3.06 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 117 F 9.41 4.20 0.00 3.17 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 0.00 118 G 8.58 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Y 7.07 4.99 0.00 2.73 2.90 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 0.00 0.00 0.00 120 Y 8.61 4.64 0.00 3.01 2.86 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 0.00 121 K 8.85 5.42 0.00 1.93 2.01 0.00 1.33 0.00 0.00 1.45 0.00 0.00 2.92 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.47 1.55 7.81 122 A 9.12 4.57 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 8.50 5.64 0.00 3.40 3.37 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 0.00 124 K 9.39 4.78 0.00 1.94 1.98 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.37 1.40 7.81 125 I 8.38 4.96 2.12 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.03 1.03 0.00 0.00 126 S 7.74 4.30 0.00 3.02 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 0.00 127 C 8.44 4.63 0.00 2.97 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 0.00 128 K 8.75 3.84 0.00 1.74 1.46 0.00 1.62 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.40 1.46 7.81 129 G 8.09 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 0.00 130 H 7.53 4.60 0.00 3.24 3.23 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.21 0.00 2.05 2.16 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 132 L 7.85 4.53 0.00 1.66 1.69 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 133 A 8.10 4.28 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 0.00 134 E 7.91 5.06 0.00 1.80 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 2.19 2.31 0.00 135 L 9.01 5.05 0.00 1.56 1.49 0.92 0.37 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 0.00 136 S 8.63 5.30 0.00 3.83 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 0.00 137 R 8.81 4.74 0.00 1.76 1.80 0.00 3.19 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 138 T 8.59 4.93 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 1.25 0.00 0.00 139 I 8.86 4.54 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.63 0.92 0.00 0.00 140 V 8.27 4.53 2.09 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 0.76 0.00 0.00 0.94 0.00 0.00 141 P 0.00 4.36 0.00 2.04 1.99 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.08 0.00 142 E 9.42 4.25 0.00 1.98 1.85 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 2.24 2.12 0.00 143 E 7.72 4.78 0.00 1.92 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.10 0.00 144 A 8.47 4.54 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 0.00 145 R 8.59 4.11 0.00 1.82 1.96 0.00 3.10 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.93 0.00 146 V 8.12 4.01 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 0.71 0.00 0.00 0.93 0.00 0.00