NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7161 8.2876 120.3920 56.1013 31.7999 175.2363 2 K 3.9256 8.3009 117.3232 58.9487 32.3517 176.5909 3 C 4.9433 7.9987 115.7507 56.1745 43.3167 174.7331 4 D 4.5816 7.8111 118.9390 53.9249 41.4771 177.0877 5 I 3.8826 8.2476 117.6999 63.2773 37.3605 177.9686 6 T 3.8776 8.3364 118.5242 66.9312 68.2132 175.9568 7 L 3.9755 8.0956 120.8531 57.8821 41.5928 179.3417 8 Q 4.0479 8.0519 118.9486 59.2118 29.1083 177.7379 9 E 3.9671 8.2324 119.6770 59.5812 29.4639 179.5309 10 I 3.8551 8.0837 120.0046 64.4330 37.1646 178.5771 11 I 3.6883 7.8584 120.6721 64.1187 36.9257 178.5431 12 K 3.8770 8.3448 119.7020 59.6355 31.7892 178.8544 13 D 4.3775 8.0097 118.9472 57.6235 40.7219 179.1617 14 L 4.0037 8.0839 119.2575 57.7341 41.3677 179.1245 15 N 4.2677 8.3500 116.0053 56.5860 38.6527 177.3376 16 S 4.4129 7.9284 115.8403 61.6185 62.9536 176.7315 17 L 4.0280 8.0490 121.9701 57.7052 41.1630 178.8351 18 T 4.2420 7.8416 106.9518 62.7134 69.1320 175.9118 19 E 4.1560 7.7766 121.6135 57.5969 29.9407 176.7685 20 Q 4.1859 7.4567 118.8988 55.2406 29.3504 175.9993 21 K 4.3909 8.3910 123.2903 54.0635 33.1050 175.0030 22 T 4.7775 9.3144 116.8687 58.5954 73.2523 174.0146 23 L 3.9514 8.5589 121.4297 58.6109 42.1554 178.9192 24 C 4.5194 8.2065 118.0751 59.8396 44.7219 175.0852 25 T 3.9426 8.0262 110.0315 63.4574 68.4154 175.6547 26 E 4.3136 7.8133 120.6239 56.8638 30.1747 176.5141 27 L 4.5118 7.4724 120.0120 54.8731 43.1314 176.1779 28 T 5.2020 8.4663 110.5920 60.5382 71.4864 173.7774 29 V 4.6503 8.8196 114.8114 59.3981 36.2367 175.3239 30 T 4.1455 8.3254 119.1983 63.9750 69.1654 174.7930 31 D 4.7949 9.2272 127.3134 52.7491 40.1112 176.5820 32 I 3.6493 8.1089 119.6208 62.8976 37.8502 177.9369 33 F 4.5852 7.5949 118.3271 57.5265 38.5831 176.0483 34 A 4.3757 7.8694 122.9475 52.2610 17.6634 178.4007 35 A 4.2854 7.3674 119.1753 52.1463 18.8858 178.7496 36 S 3.8094 8.3372 115.0425 58.9892 63.0766 174.5361 37 K 4.3382 7.1727 122.2822 56.9606 33.1687 175.8042 38 N 5.0973 8.0920 110.3275 50.8671 36.9704 173.3606 39 T 4.6066 7.1499 106.2377 59.7962 72.4583 174.4009 40 T 4.0400 8.1787 116.6386 61.6071 69.4759 174.8154 41 E 3.5902 8.4999 123.8956 59.2055 29.6197 178.8456 42 K 4.0777 7.7931 117.9394 59.6683 32.1001 178.9420 43 E 3.9764 8.0727 118.9320 59.4037 29.6267 178.7721 44 T 3.7511 7.9712 116.0706 66.6633 68.4211 176.5838 45 F 4.4587 7.7488 119.6200 60.6850 38.8946 176.9634 46 C 4.0309 8.1705 118.1498 59.5451 39.7019 175.7415 47 R 3.8232 8.1168 119.5278 59.2655 29.6759 178.9557 48 A 4.1257 8.0265 120.1457 55.2371 18.4336 179.5686 49 A 4.0597 7.7835 120.7251 54.6918 18.0743 180.1660 50 T 3.9945 7.5294 114.3200 67.0525 68.5879 177.5207 51 V 3.9200 7.5188 115.6083 63.8735 31.4236 178.7315 52 L 3.9907 7.9073 118.8754 57.5767 41.4429 179.4943 53 R 2.9694 8.0007 118.8514 59.0360 29.8721 178.3737 54 Q 3.7122 8.0004 117.9148 58.9143 28.7580 178.8176 55 F 3.9488 8.1459 121.5530 61.5621 39.5271 176.8303 56 Y 4.4315 8.2863 117.4562 60.0894 37.5753 178.2226 57 S 4.1625 7.3538 116.3726 61.9501 63.0407 176.1056 58 H 4.4234 7.8843 117.1881 57.8324 28.8585 176.4180 59 H 4.8038 7.9209 115.7528 55.2067 29.4226 175.5694 60 E 4.1170 8.2061 122.2944 58.6514 29.5632 177.6756 61 K 4.6044 7.8594 115.1729 55.8995 32.9655 175.1196 62 D 4.5143 7.9451 120.2241 53.8962 41.4733 177.4620 63 T 3.8957 8.5362 117.5392 64.8083 68.7148 176.2738 64 R 4.0741 8.3101 119.8659 58.3124 30.1208 177.0490 65 C 4.7264 7.8554 115.0604 58.1944 36.1111 175.7078 66 L 3.8082 7.6880 120.2691 55.0944 41.3167 177.9858 67 G 4.0983 7.9351 103.9124 45.8975 0.0000 173.0231 68 A 4.1801 9.3988 125.4305 54.1604 19.5583 178.8718 69 T 4.4638 7.7509 105.4633 60.2221 71.9966 175.5895 70 A 4.1194 8.3842 122.4732 55.4247 18.3066 179.5413 71 Q 3.9790 8.1175 117.5266 59.5154 29.1440 178.4510 72 Q 4.0412 8.2288 119.0629 58.9430 28.6985 178.5360 73 F 4.9470 8.4097 123.0602 61.1002 39.4112 176.5337 74 H 3.9178 8.7170 118.3444 59.5229 29.5879 177.5013 75 R 4.0258 8.2988 119.8822 59.2680 29.8056 178.6006 76 H 4.1819 8.4829 118.2813 59.2869 29.8876 177.5055 77 K 3.8335 8.0975 120.4368 59.4393 31.7053 179.3416 78 Q 3.8651 8.0450 118.3868 58.7035 28.5404 178.5608 79 L 3.9094 7.9544 121.4106 58.2784 42.0756 179.1398 80 I 3.7180 7.7577 119.6350 64.3871 36.9992 178.5204 81 R 3.8145 8.0195 118.9562 59.5678 29.8419 178.9493 82 D 4.3325 8.2978 118.6514 57.1605 40.7160 178.8016 83 L 4.0305 8.2955 120.0276 57.8024 41.5625 179.7391 84 K 3.7450 8.1377 118.6953 59.2716 31.8750 179.6765 85 R 3.8958 8.0942 118.4501 59.1685 29.9315 178.8962 86 L 4.2375 8.1413 121.7168 57.5850 42.0562 178.4178 87 D 4.2822 8.5617 118.4487 57.3162 41.3557 177.8972 88 R 4.1089 8.3953 119.5628 59.9640 29.9804 178.1807 89 N 4.3824 8.1998 115.9258 56.2673 38.5186 177.4774 90 L 3.7842 8.2067 120.7458 57.5177 41.7752 179.5993 91 W 4.5299 8.4352 119.2327 59.7637 28.7451 178.7260 92 G 3.7609 8.0120 104.5574 47.8449 0.0000 175.2914 93 L 4.2110 7.4959 119.4432 56.7164 41.7175 179.0984 94 A 4.5126 8.0498 120.6016 54.3702 18.6525 179.0215 95 G 4.0554 8.0888 103.0664 45.9880 0.0000 173.4171 96 L 4.4967 7.8984 115.0375 53.7978 45.4942 174.4664 97 N 4.9180 8.9185 120.1221 53.9266 40.4628 174.7511 98 S 4.6049 7.9942 112.5554 57.5422 62.2512 172.6248 99 C 4.9119 8.0894 120.5818 53.6584 42.2500 170.8875 100 P 4.3776 0.0000 0.0000 63.4378 31.7433 176.2358 101 V 4.2184 8.2939 116.5844 60.0318 32.6270 175.9592 102 K 4.4552 8.3997 122.8687 56.0505 33.4249 176.6135 103 E 4.0339 8.0213 118.6373 56.5371 30.0908 176.8314 104 A 4.1303 8.6181 126.1039 55.0306 19.2601 177.8056 105 N 4.3440 8.1239 114.2747 54.7068 39.9068 173.1993 106 Q 5.2056 8.7463 124.4452 54.2310 31.0612 175.0163 107 S 5.0637 8.7356 118.2172 56.1331 66.6199 173.9600 108 T 4.3757 8.4568 110.7290 61.6681 69.3625 174.8295 109 L 3.8168 8.9224 125.4523 58.2555 41.9332 178.8925 110 E 3.8962 8.2254 119.1823 59.7992 29.5534 178.8394 111 N 4.4041 8.2931 116.1628 56.0443 38.5579 177.3073 112 F 4.1752 8.4254 122.2070 61.3684 39.5306 177.2172 113 L 4.0475 8.6228 119.0542 57.9048 41.3950 179.3873 114 E 3.9052 8.2118 118.5936 59.2780 29.3584 179.4438 115 R 3.5927 7.8581 118.8555 59.0992 29.9988 178.3152 116 L 3.5547 7.5226 120.1934 57.6995 41.9313 178.8486 117 K 3.8502 8.0208 119.6851 59.7011 32.1458 178.7639 118 T 3.7747 7.6544 115.9591 66.8381 68.3976 176.6028 119 I 3.6515 7.5253 121.4470 64.5863 37.0495 178.5155 120 M 4.1830 8.3662 119.9401 58.4936 31.7215 179.0168 121 R 3.9222 8.3418 118.6477 59.0653 30.1306 178.7498 122 E 3.9268 8.2709 119.1733 59.1885 29.4475 178.9460 123 K 3.9638 7.9352 117.2229 59.6573 32.4523 178.2116 124 Y 4.1116 8.2343 119.7222 60.9158 38.2960 178.1548 125 S 4.2488 8.5849 114.2252 61.4641 62.2800 176.0455 126 K 4.1409 8.0821 119.4204 58.5459 31.9063 177.8440 127 C 4.5125 7.9412 116.2381 56.8211 40.7080 173.5160 128 S 4.7888 6.7919 113.6060 55.7078 65.1404 174.2791 129 S 4.2734 8.4264 114.2863 58.7138 62.7877 174.0879 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 H 8.29 4.72 0.00 3.22 3.36 0.00 5.67 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 2 K 8.30 3.93 0.00 2.02 1.99 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.49 7.81 3 C 8.00 4.94 0.00 2.91 3.01 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 0.00 0.00 0.00 4 D 7.81 4.58 0.00 2.94 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.25 3.88 1.89 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 1.63 0.37 0.91 0.00 0.00 6 T 8.34 3.88 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 1.14 0.00 0.00 7 L 8.10 3.98 0.00 1.79 1.88 0.96 0.67 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 8 Q 8.05 4.05 0.00 2.39 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.88 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 9 E 8.23 3.97 0.00 2.19 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 2.34 2.50 0.00 10 I 8.08 3.86 1.99 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.64 0.90 0.00 0.00 11 I 7.86 3.69 1.92 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 1.47 0.61 0.79 0.00 0.00 12 K 8.34 3.88 0.00 1.95 1.84 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.44 1.77 7.81 13 D 8.01 4.38 0.00 2.88 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 14 L 8.08 4.00 0.00 1.79 1.68 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.35 4.27 0.00 2.78 2.86 0.00 0.00 7.10 7.48 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 16 S 7.93 4.41 0.00 3.86 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 17 L 8.05 4.03 0.00 1.82 1.71 0.96 0.48 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 18 T 7.84 4.24 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 19 E 7.78 4.16 0.00 2.03 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 2.33 2.44 0.00 20 Q 7.46 4.19 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 21 K 8.39 4.39 0.00 1.73 1.67 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.42 7.81 22 T 9.31 4.78 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 23 L 8.56 3.95 0.00 1.66 1.78 0.94 0.93 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 24 C 8.21 4.52 0.00 3.14 3.22 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 25 T 8.03 3.94 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 26 E 7.81 4.31 0.00 2.11 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 0.00 2.51 2.51 0.00 27 L 7.47 4.51 0.00 1.93 1.62 0.65 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.47 5.20 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 1.26 0.00 0.00 29 V 8.82 4.65 1.64 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 0.69 0.00 0.00 0.47 0.00 0.00 30 T 8.33 4.15 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 31 D 9.23 4.79 0.00 2.86 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 32 I 8.11 3.65 1.57 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.36 0.85 0.00 0.00 33 F 7.59 4.59 0.00 3.01 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 34 A 7.87 4.38 1.42 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 35 A 7.37 4.29 1.36 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 0.00 0.00 0.00 36 S 8.34 3.81 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 37 K 7.17 4.34 0.00 1.82 2.15 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.27 1.23 7.81 38 N 8.09 5.10 0.00 2.80 2.80 0.00 0.00 6.02 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.15 4.61 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 40 T 8.18 4.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 41 E 8.50 3.59 0.00 1.97 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 1.71 2.19 0.00 42 K 7.79 4.08 0.00 1.88 1.91 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.82 1.52 7.81 43 E 8.07 3.98 0.00 2.02 2.15 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 2.35 2.39 0.00 44 T 7.97 3.75 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 45 F 7.75 4.46 0.00 3.21 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 46 C 8.17 4.03 0.00 3.12 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.12 3.82 0.00 1.98 1.87 0.00 3.13 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 48 A 8.03 4.13 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.78 4.06 -0.27 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 50 T 7.53 3.99 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 51 V 7.52 3.92 1.82 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 0.96 0.00 0.00 0.54 0.00 0.00 52 L 7.91 3.99 0.00 1.92 1.83 1.09 0.79 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 53 R 8.00 2.97 0.00 2.39 2.14 0.00 3.57 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.33 0.00 54 Q 8.00 3.71 0.00 2.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 55 F 8.15 3.95 0.00 3.05 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.29 4.43 0.00 3.30 3.39 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 57 S 7.35 4.16 0.00 3.78 3.88 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 58 H 7.88 4.42 0.00 2.80 3.00 0.00 5.63 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 7.92 4.80 0.00 2.92 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.21 4.12 0.00 2.23 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 0.00 2.43 2.39 0.00 61 K 7.86 4.60 0.00 1.78 1.79 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.43 7.81 62 D 7.95 4.51 0.00 2.74 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 63 T 8.54 3.90 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 64 R 8.31 4.07 0.00 1.89 2.04 0.00 3.13 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 65 C 7.86 4.73 0.00 3.03 3.12 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 66 L 7.69 3.81 0.00 1.61 1.59 0.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.94 4.10 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 0.00 0.00 0.00 68 A 9.40 4.18 1.31 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 0.00 0.00 69 T 7.75 4.46 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 70 A 8.38 4.12 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 71 Q 8.12 3.98 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 72 Q 8.23 4.04 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 73 F 8.41 4.95 0.00 3.04 3.22 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 74 H 8.72 3.92 0.00 3.25 3.53 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.30 4.03 0.00 2.05 1.98 0.00 3.22 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 76 H 8.48 4.18 0.00 3.47 3.63 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.10 3.83 0.00 1.52 1.64 0.00 1.43 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.27 1.01 7.81 78 Q 8.04 3.87 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 79 L 7.95 3.91 0.00 2.02 1.84 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.76 3.72 1.79 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 1.53 0.74 0.86 0.00 0.00 81 R 8.02 3.81 0.00 2.00 1.92 0.00 3.07 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 82 D 8.30 4.33 0.00 2.83 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 83 L 8.30 4.03 0.00 1.88 1.93 1.10 0.78 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 84 K 8.14 3.74 0.00 1.70 1.63 0.00 1.41 0.00 0.00 1.39 0.00 0.00 2.68 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.66 7.81 85 R 8.09 3.90 0.00 2.00 2.06 0.00 3.10 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 86 L 8.14 4.24 0.00 1.78 1.94 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.56 4.28 0.00 3.27 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 88 R 8.40 4.11 0.00 2.09 2.22 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 89 N 8.20 4.38 0.00 2.91 2.80 0.00 0.00 7.11 6.87 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 90 L 8.21 3.78 0.00 1.59 1.51 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 91 W 8.44 4.53 0.00 3.57 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 92 G 8.01 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 93 L 7.50 4.21 0.00 1.38 1.00 0.83 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.05 4.51 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.09 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 96 L 7.90 4.50 0.00 1.70 1.64 1.05 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.92 4.92 0.00 2.58 2.80 0.00 0.00 7.05 7.63 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 98 S 7.99 4.60 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 99 C 8.09 4.91 0.00 3.07 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 0.00 100 P 0.00 4.38 0.00 2.07 2.05 0.00 3.67 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 2.04 2.12 0.00 101 V 8.29 4.22 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 0.76 0.00 0.00 0.91 0.00 0.00 102 K 8.40 4.46 0.00 1.71 1.82 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.42 7.81 103 E 8.02 4.03 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 104 A 8.62 4.13 1.28 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 0.00 105 N 8.12 4.34 0.00 2.84 2.76 0.00 0.00 6.99 7.12 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 0.00 106 Q 8.75 5.21 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 107 S 8.74 5.06 0.00 3.98 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 0.00 108 T 8.46 4.38 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 1.29 0.00 0.00 109 L 8.92 3.82 0.00 1.23 1.66 0.31 0.19 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 0.00 110 E 8.23 3.90 0.00 2.21 1.97 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 2.32 2.38 0.00 111 N 8.29 4.40 0.00 2.86 2.90 0.00 0.00 6.75 7.67 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 0.00 112 F 8.43 4.18 0.00 3.22 3.24 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 0.00 113 L 8.62 4.05 0.00 1.86 1.72 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.21 3.91 0.00 2.09 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 2.43 2.44 0.00 115 R 7.86 3.59 0.00 1.78 1.41 0.00 2.85 0.00 0.00 2.89 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.54 0.00 116 L 7.52 3.55 0.00 1.59 1.65 1.05 0.55 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 0.00 117 K 8.02 3.85 0.00 1.91 1.85 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.43 7.81 118 T 7.65 3.77 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 119 I 7.53 3.65 1.80 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.60 0.89 0.00 0.00 120 M 8.37 4.18 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.96 0.00 121 R 8.34 3.92 0.00 1.78 1.93 0.00 3.04 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 122 E 8.27 3.93 0.00 2.14 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 2.29 2.40 0.00 123 K 7.94 3.96 0.00 2.06 1.97 0.00 2.03 0.00 0.00 1.95 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.69 1.49 7.81 124 Y 8.23 4.11 0.00 3.13 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 0.00 125 S 8.58 4.25 0.00 4.05 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 0.00 126 K 8.08 4.14 0.00 1.93 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.61 1.62 7.81 127 C 7.94 4.51 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 6.79 4.79 0.00 3.94 3.64 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 0.00 129 S 8.43 4.27 0.00 4.00 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