NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4907 8.1627 120.3296 55.4169 34.3875 177.3488 2 L 3.8490 7.8128 119.7931 57.0763 41.9643 177.1842 3 K 4.1422 8.2399 119.6853 59.2221 32.6596 178.5927 4 G 3.5864 7.9518 105.7113 47.7126 0.0000 175.4606 5 F 4.2322 8.4360 123.4422 60.9166 39.4832 177.2357 6 K 4.0314 8.3304 119.4328 59.5322 31.5044 178.4549 7 E 4.0350 8.5276 119.9517 59.1231 29.3182 178.5570 8 F 4.7027 8.1880 120.2218 61.2006 39.6841 176.9429 9 L 3.9580 8.1293 118.7496 57.4794 41.1691 179.2341 10 A 4.0285 7.9031 120.1474 55.0388 18.3723 179.3293 11 R 4.0868 7.6321 115.9004 58.6981 31.6584 177.8430 12 G 3.8253 7.9684 107.4163 44.9965 0.0000 173.3967 13 N 4.2694 7.7936 121.1513 56.7892 39.4833 175.8727 14 I 3.5737 7.4964 121.0111 64.2835 37.2134 178.2390 15 V 3.4532 7.6177 118.9782 66.0104 31.3156 177.7006 16 D 4.3211 7.9594 118.0892 57.3267 40.7117 178.5165 17 L 3.8733 7.9743 120.4337 58.0011 42.0445 178.7182 18 A 3.9564 8.6467 121.3579 55.2576 18.2997 179.7220 19 V 3.4876 7.8946 116.4576 65.9975 31.5344 178.0247 20 A 3.9513 7.8701 120.5131 55.4068 18.1923 180.1185 21 V 3.6105 8.2693 111.2994 64.2521 31.5408 179.0289 22 V 3.5878 7.9827 118.4472 66.2168 31.4413 178.2750 23 I 3.9438 8.0564 119.7484 64.0559 36.9210 178.7700 24 G 3.6356 8.2994 107.0491 47.9942 0.0000 175.9786 25 T 3.9616 8.2250 112.6304 64.3491 68.8022 176.4534 26 A 4.0171 8.0967 123.7810 54.8401 18.4574 179.4538 27 F 4.0907 8.4688 119.3759 61.6275 39.5593 177.4303 28 T 3.7808 8.3271 109.3134 64.7603 68.4350 176.1442 29 A 3.9791 8.0954 123.5541 54.7901 18.4056 179.3707 30 L 3.8433 7.7223 118.8076 58.1868 42.1775 179.3187 31 V 3.4313 7.4114 118.3802 66.2362 31.3664 178.1606 32 T 4.7040 7.8759 110.7771 64.2768 68.4944 176.7171 33 K 3.9604 8.1469 121.4529 59.1237 32.0851 178.9908 34 F 4.0008 8.3524 120.9499 61.5914 39.1752 177.2397 35 T 4.0340 8.3081 115.3029 66.8291 68.0496 176.3760 36 D 4.8303 8.4224 121.3360 56.8132 40.9517 178.8048 37 S 4.1624 8.0260 113.7187 61.5067 62.0284 176.3302 38 I 3.6283 7.5794 124.2871 63.6508 36.8907 178.5768 39 I 3.8499 7.2413 119.9786 64.6883 37.1818 178.4719 40 T 3.8865 8.0614 117.0048 65.8950 68.2241 174.9032 41 P 4.2093 0.0000 0.0000 65.8857 30.9267 178.4258 42 L 3.9566 7.3436 118.4125 57.5343 41.4422 179.5364 43 I 3.8453 7.8136 119.6368 64.5889 36.8188 178.3244 44 N 4.3311 8.2275 116.6060 56.0799 38.4030 177.1099 45 R 4.0081 7.9047 119.5848 59.5506 30.1272 178.3777 46 I 3.7501 7.6368 119.5350 63.8694 38.6317 178.2330 47 G 3.6675 7.7082 105.7777 47.2298 0.0000 174.3868 48 V 4.3249 7.4377 120.0280 62.9711 33.8480 175.1634 49 N 4.2037 9.3095 117.7012 54.3329 36.5205 179.6373 50 A 4.2791 8.0041 122.4148 56.6060 15.9212 178.1480 51 Q 4.3514 7.5943 122.3438 56.7617 31.8115 173.1781 52 S 4.4942 7.7748 109.5059 60.2449 66.0982 174.7183 53 D 4.4743 8.2392 116.1731 53.5420 45.0133 176.1751 54 V 3.7441 8.6672 123.1046 64.0550 32.4306 176.5295 55 G 3.9799 8.6172 113.1203 44.9707 0.0000 170.0022 56 I 5.1649 7.8894 127.2548 58.4056 37.4801 172.7881 57 L 3.8458 8.0510 122.9579 54.5025 42.6535 177.3581 58 R 4.1192 8.3022 127.8984 53.3580 28.2224 174.7634 59 I 4.3826 6.7425 127.2805 61.0216 40.5788 173.8005 60 G 4.1385 8.7153 106.8554 46.5646 0.0000 172.5526 61 I 4.4568 8.0872 118.9742 60.1215 41.3333 175.6055 62 G 3.1055 9.0618 121.6812 46.0798 0.0000 171.6195 63 G 4.0107 7.8489 120.4306 44.5946 0.0000 172.7365 64 G 4.2841 7.7858 107.3904 46.0324 0.0000 171.5705 65 Q 4.8850 8.0721 120.2180 54.7172 32.8495 173.3718 66 T 5.0805 8.4982 114.3637 60.1138 72.4109 173.8395 67 I 4.3043 8.5597 125.0959 59.5083 38.2240 173.7504 68 D 4.5524 8.4346 125.9627 54.0782 41.0183 177.1317 69 L 4.2831 8.5778 125.5662 56.8842 42.0063 178.7071 70 N 4.3312 8.1234 117.0479 55.9818 37.1121 177.5000 71 V 3.5926 7.6780 120.9519 64.3575 31.5876 177.9599 72 L 3.8788 7.7133 120.5881 57.8413 41.9529 178.6216 73 L 3.9242 8.0188 120.2971 57.9883 41.9818 178.7243 74 S 4.0190 8.3925 113.4552 61.3909 62.2975 176.1103 75 A 4.0324 8.6601 123.5703 54.8797 18.0290 179.5391 76 A 3.9776 7.9940 119.4026 55.4897 18.4314 179.9521 77 I 3.4034 7.9097 118.5908 64.2560 37.0725 178.1413 78 N 4.4923 8.0699 119.3728 56.1062 38.7219 176.6240 79 F 4.3727 8.4580 122.0095 61.4995 39.4979 177.0586 80 F 4.1484 8.8544 117.4916 60.7019 38.6789 177.6214 81 L 3.7747 8.1796 118.6308 57.7345 41.3237 179.8191 82 I 3.7790 7.7838 119.6389 64.2016 37.1043 178.2088 83 A 3.9439 8.1174 121.9636 55.2270 18.1918 179.7244 84 F 4.2851 9.3567 116.4506 60.7211 38.9718 177.8142 85 A 4.1675 8.7081 121.1080 55.1728 18.2640 180.1428 86 V 3.4539 8.5461 118.1704 65.0783 31.5677 178.0685 87 Y 4.0670 8.2097 120.5036 60.1913 38.4655 177.6282 88 F 3.2308 8.4462 120.6792 60.8650 39.6173 176.7626 89 L 4.1903 8.1699 119.0421 58.1926 42.3208 178.7717 90 V 3.6725 7.7520 118.1022 65.9222 31.4870 178.2529 91 V 3.5977 7.6881 118.0726 65.6896 31.4214 177.6511 92 L 3.7227 7.3896 119.8499 57.4813 41.8121 177.0956 93 P 4.1849 0.0000 0.0000 66.1125 31.4993 177.8133 94 Y 3.9745 8.0758 119.7035 60.1502 38.7188 177.2053 95 N 4.3116 8.4895 118.2784 57.0200 38.9924 177.0769 96 T 3.8668 7.9293 117.1896 66.5489 68.5226 176.8334 97 L 3.9386 8.1417 121.2775 57.5987 41.4711 179.8132 98 R 3.7288 7.7980 118.1784 58.9367 29.7551 179.1489 99 K 3.9102 7.7232 117.2047 59.4199 32.2408 179.1887 100 K 4.1633 8.2213 116.3682 56.6499 32.0799 178.2668 101 G 3.8477 8.0664 107.1720 45.4255 0.0000 174.2091 102 E 3.9329 7.9082 121.0674 58.9599 29.7399 177.9359 103 V 3.6485 7.4231 117.0864 62.4971 32.1050 174.1915 104 E 4.6471 7.9053 125.8362 54.1587 32.6775 174.9565 105 Q 4.5835 7.9089 117.9933 53.5464 32.7415 172.0890 106 P 4.3506 0.0000 0.0000 66.1677 31.2143 178.9343 107 G 3.6276 8.0586 104.9623 47.5654 0.0000 175.2064 108 D 4.3851 8.0422 121.2829 57.2894 40.9755 178.8402 109 T 3.9063 8.0139 110.2483 64.7926 68.6047 176.4822 110 Q 3.9745 8.1312 120.9145 58.8081 28.7739 178.9103 111 V 3.5557 7.7595 119.1624 65.9376 31.5637 178.1369 112 V 3.5637 7.8498 117.8811 66.0767 31.2939 178.0430 113 L 4.0042 8.0074 118.5858 57.8314 41.4456 179.4554 114 L 4.0018 8.4901 119.2393 58.0613 41.4693 179.8570 115 T 3.8786 8.4132 115.9994 66.6329 68.4053 176.6250 116 E 3.9454 8.6551 120.8603 59.5151 29.4140 179.4659 117 I 3.6744 8.0944 120.1453 64.3296 37.1511 178.3962 118 R 3.8746 8.3055 119.8681 59.5789 29.6990 178.2841 119 D 4.3553 8.4017 117.6717 57.4272 41.1428 178.5611 120 L 4.1303 8.5842 119.8086 57.6718 41.8020 179.2206 121 L 3.9664 8.3574 120.5009 58.1259 41.8042 178.9597 122 A 4.1253 8.0122 120.8365 55.1221 18.0487 179.6598 123 Q 3.9832 7.8843 116.0023 59.2528 28.8677 178.6213 124 T 3.9954 7.4763 114.5548 65.5323 68.4609 174.0024 125 N 4.5752 7.6301 122.6441 53.2191 38.9075 174.3607 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 4.49 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 2 L 7.81 3.85 0.00 1.80 1.68 0.93 0.12 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 3 K 8.24 4.14 0.00 1.89 1.81 0.00 1.78 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.53 7.81 4 G 7.95 3.59 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 0.00 5 F 8.44 4.23 0.00 3.27 3.13 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 6 K 8.33 4.03 0.00 2.05 1.96 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 7 E 8.53 4.03 0.00 2.31 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 2.36 2.35 0.00 8 F 8.19 4.70 0.00 3.13 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 9 L 8.13 3.96 0.00 1.90 1.65 0.99 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.90 4.03 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 11 R 7.63 4.09 0.00 2.03 2.21 0.00 3.43 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.57 0.00 12 G 7.97 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 13 N 7.79 4.27 0.00 2.79 2.74 0.00 0.00 7.06 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 14 I 7.50 3.57 1.56 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.41 0.72 0.00 0.00 15 V 7.62 3.45 2.18 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 0.99 0.00 0.00 0.86 0.00 0.00 16 D 7.96 4.32 0.00 2.97 2.66 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 17 L 7.97 3.87 0.00 1.78 1.78 0.89 0.94 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 18 A 8.65 3.96 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 19 V 7.89 3.49 2.21 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 0.99 0.00 0.00 1.02 0.00 0.00 20 A 7.87 3.95 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 21 V 8.27 3.61 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 0.75 0.00 0.00 0.97 0.00 0.00 22 V 7.98 3.59 2.34 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 1.05 0.00 0.00 0.97 0.00 0.00 23 I 8.06 3.94 1.85 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 1.46 0.88 0.90 0.00 0.00 24 G 8.30 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 0.00 0.00 0.00 25 T 8.23 3.96 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 1.24 0.00 0.00 26 A 8.10 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.47 4.09 0.00 3.14 3.19 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 0.00 28 T 8.33 3.78 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 1.46 0.00 0.00 29 A 8.10 3.98 1.45 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 30 L 7.72 3.84 0.00 1.85 1.51 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.41 3.43 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 0.96 0.00 0.00 0.32 0.00 0.00 32 T 7.88 4.70 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 1.41 0.00 0.00 33 K 8.15 3.96 0.00 1.98 1.90 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.60 1.59 7.81 34 F 8.35 4.00 0.00 3.08 3.13 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 35 T 8.31 4.03 4.48 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 1.29 0.00 0.00 36 D 8.42 4.83 0.00 2.74 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 37 S 8.03 4.16 0.00 3.87 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 38 I 7.58 3.63 0.68 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.29 0.65 0.00 0.00 39 I 7.24 3.85 1.96 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.86 0.91 0.00 0.00 40 T 8.06 3.89 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 1.24 0.00 0.00 41 P 0.00 4.21 0.00 2.21 2.25 0.00 3.49 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 2.15 2.21 0.00 42 L 7.34 3.96 0.00 2.01 1.73 0.98 0.76 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 43 I 7.81 3.85 1.97 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 1.75 0.96 0.88 0.00 0.00 44 N 8.23 4.33 0.00 2.83 2.86 0.00 0.00 7.01 7.26 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 45 R 7.90 4.01 0.00 1.79 1.95 0.00 3.41 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 46 I 7.64 3.75 2.06 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 1.44 0.73 0.90 0.00 0.00 47 G 7.71 3.67 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 0.00 0.00 0.00 48 V 7.44 4.32 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 0.85 0.00 0.00 0.98 0.00 0.00 49 N 9.31 4.20 0.00 2.73 2.40 0.00 0.00 7.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.00 4.28 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 51 Q 7.59 4.35 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.65 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 52 S 7.77 4.49 0.00 4.22 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.24 4.47 0.00 2.77 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.67 3.74 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 0.81 0.00 0.00 0.93 0.00 0.00 55 G 8.62 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 56 I 7.89 5.16 1.87 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 1.30 0.72 0.95 0.00 0.00 57 L 8.05 3.85 0.00 1.60 1.64 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.30 4.12 0.00 1.77 1.86 0.00 3.48 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 59 I 6.74 4.38 1.87 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 1.35 0.57 0.91 0.00 0.00 60 G 8.72 4.14 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 0.00 0.00 0.00 61 I 8.09 4.46 1.87 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 1.34 0.78 0.91 0.00 0.00 62 G 9.06 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 0.00 0.00 0.00 63 G 7.85 4.01 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 0.00 0.00 0.00 64 G 7.79 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 65 Q 8.07 4.88 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 66 T 8.50 5.08 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 67 I 8.56 4.30 1.86 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 1.22 1.23 0.90 0.00 0.00 68 D 8.43 4.55 0.00 2.63 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 69 L 8.58 4.28 0.00 1.63 1.68 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 70 N 8.12 4.33 0.00 2.89 3.07 0.00 0.00 6.03 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 71 V 7.68 3.59 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 0.81 0.00 0.00 0.92 0.00 0.00 72 L 7.71 3.88 0.00 1.75 1.89 0.89 0.52 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 73 L 8.02 3.92 0.00 1.72 1.60 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.39 4.02 0.00 3.98 4.01 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 75 A 8.66 4.03 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 76 A 7.99 3.98 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 77 I 7.91 3.40 1.97 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 1.20 0.64 0.86 0.00 0.00 78 N 8.07 4.49 0.00 2.91 3.05 0.00 0.00 6.53 7.84 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 79 F 8.46 4.37 0.00 3.33 3.55 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 0.00 80 F 8.85 4.15 0.00 3.06 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 81 L 8.18 3.77 0.00 1.81 1.57 0.81 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.78 3.78 1.87 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.79 1.07 0.00 0.00 83 A 8.12 3.94 1.18 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 0.00 0.00 84 F 9.36 4.29 0.00 3.15 3.25 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 0.00 0.00 0.00 0.00 85 A 8.71 4.17 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 0.00 0.00 0.00 0.00 0.00 86 V 8.55 3.45 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 0.99 0.00 0.00 0.85 0.00 0.00 87 Y 8.21 4.07 0.00 3.04 3.25 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 0.00 0.00 0.00 0.00 88 F 8.45 3.23 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.17 4.19 0.00 1.72 1.81 0.96 0.89 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 90 V 7.75 3.67 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 0.81 0.00 0.00 0.72 0.00 0.00 91 V 7.69 3.60 2.21 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 1.14 0.00 0.00 1.02 0.00 0.00 92 L 7.39 3.72 0.00 1.16 1.37 0.46 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.18 0.00 2.32 2.26 0.00 3.61 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 2.24 2.22 0.00 94 Y 8.08 3.97 0.00 3.12 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 95 N 8.49 4.31 0.00 3.07 2.77 0.00 0.00 7.23 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 7.93 3.87 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 1.15 0.00 0.00 97 L 8.14 3.94 0.00 1.43 1.55 0.90 1.09 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 98 R 7.80 3.73 0.00 1.87 1.83 0.00 3.16 0.00 0.00 2.93 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.57 0.00 99 K 7.72 3.91 0.00 1.90 1.83 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.55 7.81 100 K 8.22 4.16 0.00 1.73 1.81 0.00 1.78 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.50 7.81 101 G 8.07 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 0.00 0.00 0.00 102 E 7.91 3.93 0.00 1.91 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 0.00 2.30 2.23 0.00 103 V 7.42 3.65 1.77 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 0.61 0.00 0.00 0.60 0.00 0.00 104 E 7.91 4.65 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 105 Q 7.91 4.58 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.64 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 106 P 0.00 4.35 0.00 2.30 2.30 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 107 G 8.06 3.63 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 0.00 0.00 0.00 108 D 8.04 4.39 0.00 2.92 2.71 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 0.00 109 T 8.01 3.91 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 1.20 0.00 0.00 110 Q 8.13 3.97 0.00 2.38 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 111 V 7.76 3.56 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 0.81 0.00 0.00 1.01 0.00 0.00 112 V 7.85 3.56 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 0.89 0.00 0.00 0.95 0.00 0.00 113 L 8.01 4.00 0.00 1.91 1.69 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.49 4.00 0.00 1.83 1.71 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.41 3.88 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 1.25 0.00 0.00 116 E 8.66 3.95 0.00 2.06 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 2.32 2.66 0.00 117 I 8.09 3.67 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 1.67 0.97 0.91 0.00 0.00 118 R 8.31 3.87 0.00 1.83 2.13 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 119 D 8.40 4.36 0.00 2.82 2.71 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 0.00 120 L 8.58 4.13 0.00 1.64 1.71 0.92 0.63 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 0.00 121 L 8.36 3.97 0.00 1.89 1.77 0.92 1.00 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 0.00 122 A 8.01 4.13 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 0.00 123 Q 7.88 3.98 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 124 T 7.48 4.00 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 1.21 0.00 0.00 125 N 7.63 4.58 0.00 2.75 2.69 0.00 0.00 6.82 8.29 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