NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.2271 8.1933 115.3947 53.7188 63.9235 174.1123 3 E 3.6740 7.7595 121.9165 56.5147 28.8801 173.7103 4 E 4.0436 8.2073 119.4286 59.3417 30.5611 178.9463 5 A 2.0000 7.0466 120.3798 54.5508 18.3968 179.4377 6 L 3.9210 6.9338 116.5515 58.2389 41.7516 180.1088 7 K 4.0781 7.7102 117.9011 59.1258 31.7441 179.2385 8 W 4.5182 7.9251 118.3375 59.0891 29.0535 177.1077 9 G 3.8647 7.8608 105.7465 46.0906 0.0000 174.7598 10 E 4.0631 8.2038 121.0648 58.2890 29.9692 177.0321 11 S 4.6086 7.4042 110.9615 56.4068 66.7425 175.3409 12 L 2.8352 7.6618 123.0829 57.5300 41.4033 178.1816 13 E 3.9708 8.1788 117.4852 59.7689 29.8374 179.2293 14 K 4.1753 7.8241 117.9171 59.0007 32.2127 178.8846 15 L 3.9491 7.8195 120.7676 58.5241 41.6786 179.2379 16 L 3.9598 7.6015 116.6213 56.7901 41.5679 178.7478 17 V 4.2375 7.1249 109.4234 60.4457 32.1981 174.9816 18 H 4.6259 7.8126 120.9049 54.6428 30.4504 174.8548 19 K 3.6527 8.5674 128.1260 60.5078 31.8871 177.8074 20 Y 4.3325 7.8634 116.1497 60.7729 38.0039 178.2763 21 G 2.0000 7.7538 106.3526 46.6453 0.0000 175.3717 22 L 3.7972 7.6092 122.3303 57.8941 42.1725 178.9160 23 A 3.9595 7.5665 120.8182 55.1843 18.3061 179.8643 24 V 3.6740 7.7060 116.7347 65.9880 31.6072 178.0405 25 F 3.3907 8.2122 120.8368 60.9917 39.1487 176.4556 26 Q 3.6891 8.2274 119.4304 59.4131 28.5128 178.5925 27 A 3.9594 7.5387 119.3795 55.1297 18.6783 179.0620 28 F 4.1973 8.4066 118.9621 61.6060 39.5334 177.4795 29 L 3.6889 7.9999 118.7676 57.4717 41.3744 179.5302 30 R 4.1138 7.9657 120.4829 58.7828 29.7752 178.4099 31 T 3.6854 7.2769 108.5999 63.0343 68.6611 174.7261 32 E 4.0967 6.7999 118.0518 54.9743 30.0378 175.4761 33 F 3.9795 6.6550 115.2916 59.6566 37.3399 175.9180 34 S 5.0939 8.3940 110.2417 56.4750 63.6004 175.7895 35 E 3.9344 8.1925 122.0723 59.5689 29.3226 178.2215 36 E 4.1052 8.1995 118.6487 59.2427 29.6029 178.4997 37 N 4.4982 8.0543 117.2945 56.3945 38.5785 177.0205 38 L 4.0269 7.7786 120.8925 58.0972 42.2326 178.4635 39 E 3.9780 8.1603 118.5574 59.4373 29.3557 179.1234 40 F 2.9888 8.3530 120.8069 60.6687 39.5225 176.9357 41 W 3.5566 8.1021 127.9566 60.3094 30.4881 178.0042 42 L 3.9368 8.4242 119.1047 57.5231 41.0125 179.1337 43 A 3.8617 7.9234 120.9801 55.3627 18.2733 179.3402 44 C 3.6221 7.3876 115.1923 62.8970 27.8461 176.3044 45 E 3.6586 7.0461 118.4085 59.2110 29.2645 178.7341 46 D 4.4319 7.9390 118.8597 57.3691 40.9340 178.4236 47 F 4.1172 8.2308 121.3199 61.3125 39.1818 176.9180 48 K 3.9261 7.8313 114.7870 58.2531 32.4859 177.9688 49 K 4.2205 7.9891 119.3287 56.1433 32.8407 176.9912 50 V 3.5547 6.7508 119.9911 62.8054 31.9701 175.6103 51 K 3.9797 8.6338 128.7458 59.2676 32.6093 177.5777 52 S 4.2783 7.7688 113.4403 57.6677 63.7676 174.0732 53 Q 3.9144 8.7264 129.9915 59.4713 28.9122 178.7560 54 S 4.1503 7.9928 114.7265 61.3588 63.0961 176.4820 55 K 4.0150 8.1296 122.1666 59.3044 31.6970 179.1869 56 M 4.0615 8.8589 119.9262 58.4877 31.9982 178.7252 57 A 4.0916 8.2564 121.1233 55.2503 18.5976 179.8586 58 S 4.1950 8.1977 112.8302 61.2173 63.1966 176.6536 59 K 4.0296 8.5445 123.3295 59.3514 32.0178 178.6300 60 A 4.2687 8.6496 121.3610 55.2276 18.4024 179.8266 61 K 4.0543 8.1247 116.9123 59.4096 31.9950 179.6148 62 K 3.9955 8.7151 119.1346 59.7100 32.0659 179.2882 63 I 3.9102 8.3198 120.2772 64.3605 36.9155 178.1793 64 F 4.0411 8.5601 121.1242 61.4908 39.1006 176.9725 65 A 4.0161 7.9571 118.3842 54.8475 18.3328 178.4628 66 E 3.9802 8.0020 117.2990 57.9936 30.0364 177.1625 67 Y 4.6422 7.7841 116.6440 57.2011 39.2149 177.3504 68 I 3.6560 7.1945 118.0185 62.2790 39.1200 176.2652 69 A 3.7855 7.2963 123.1450 52.0889 18.6188 176.8865 70 I 3.9169 8.2177 122.5681 63.3754 37.5620 176.0591 71 Q 3.5636 9.1035 121.3599 56.3192 26.7726 173.8851 72 A 4.0912 7.5815 120.8534 52.1485 18.9333 178.2158 73 C 4.1526 8.6573 118.5455 62.4823 28.3551 175.2680 74 K 4.5954 7.5772 118.9394 55.3549 32.4679 176.3823 75 E 4.1114 8.2792 121.3140 57.0535 29.9014 176.6055 76 V 4.0946 8.2558 120.8255 59.9989 33.5553 176.8360 77 N 4.5489 8.6617 121.7846 53.0666 37.0243 173.5630 78 L 4.7533 7.7645 122.4743 52.1607 44.6929 176.9485 79 D 4.7594 8.2902 122.1196 52.5394 42.1008 177.8138 80 S 4.1165 8.5069 114.9761 62.0206 62.6983 175.6951 81 Y 4.2945 8.2671 121.4528 61.7349 38.3178 178.4921 82 T 3.5087 8.3023 115.9034 66.3319 68.6561 176.7060 83 R 3.9059 8.3457 120.9983 59.6189 30.0713 178.4093 84 E 4.0046 8.5637 118.6699 59.5486 29.5866 178.5810 85 H 3.9689 8.2901 118.4761 59.7489 29.6127 177.2733 86 T 3.7791 7.7988 115.7004 66.4598 68.4945 176.0357 87 K 3.4595 8.2597 121.4478 59.5665 32.2277 178.1158 88 D 4.3014 8.2521 119.2919 57.7686 40.4361 178.9036 89 N 4.3213 7.8309 115.5998 55.6521 38.2097 177.0017 90 L 3.7561 7.0994 119.3553 56.7809 41.6568 178.7551 91 Q 4.2860 7.6650 117.9886 57.2783 29.7923 176.0867 92 S 4.4610 7.2346 113.3535 55.3777 62.5961 172.1740 93 V 3.6492 7.9760 123.4218 62.8585 32.0501 175.0804 94 T 4.7591 8.0611 115.1270 60.2174 71.8629 174.3296 95 R 4.2619 8.5328 119.1345 58.0053 30.4114 177.8807 96 G 3.9171 7.8896 106.1551 45.5874 0.0000 174.9469 97 C 3.6274 7.8015 121.0650 62.0953 31.4612 175.0590 98 F 4.8536 7.7314 114.7904 57.1294 38.6048 176.8960 99 D 4.4320 8.0856 121.1517 57.4439 40.6958 178.4592 100 L 3.9646 7.9447 119.8148 58.0973 42.1708 178.6178 101 A 4.1225 8.1033 120.1387 55.3886 18.4085 179.0955 102 Q 4.0851 9.0232 119.0932 59.3325 29.0320 178.7810 103 K 4.2125 8.6002 120.1996 59.7641 32.7052 179.0237 104 R 3.9822 8.2315 119.9748 59.6288 30.0052 178.6450 105 I 3.8854 8.1497 119.4208 64.1064 37.0734 177.8600 106 F 3.9306 8.9755 122.3028 61.4395 39.1498 177.4113 107 G 3.7666 8.7636 105.3613 47.9585 0.0000 175.4460 108 L 4.0456 7.9599 121.6391 57.8228 41.5885 179.7015 109 M 4.1832 7.8951 119.8399 57.8069 31.6865 178.3403 110 E 3.5870 7.8117 118.6868 58.8067 29.7654 178.1180 111 K 4.2531 7.7185 117.5631 58.6771 32.4851 176.7371 112 D 4.6884 8.2792 118.4330 55.8543 41.1088 178.4324 113 S 4.2274 7.8333 114.8347 60.8429 63.8485 176.0090 114 Y 4.1033 8.3660 123.9480 60.3359 38.3754 175.8138 115 P 3.9354 0.0000 0.0000 65.4342 31.7254 178.5036 116 R 4.0127 7.5560 116.5646 59.1204 29.9744 178.5015 117 F 2.7147 8.1751 120.7393 61.1805 39.0222 177.3207 118 L 3.3551 7.0537 116.1587 56.6926 41.3811 178.6651 119 R 4.2378 7.1478 115.8634 55.5758 30.8842 176.7455 120 S 4.5233 7.1483 114.8179 57.4591 64.4213 175.0088 121 D 4.3332 8.7813 121.9284 57.5303 40.3121 178.6437 122 L 4.0518 8.0883 119.3352 58.7218 42.2835 178.0928 123 Y 4.1402 7.9617 119.1831 60.5846 38.7396 177.5084 124 L 3.6083 8.2289 120.2014 57.6707 41.5678 179.1025 125 D 4.4353 8.2241 117.7214 56.1264 40.7724 177.5875 126 L 4.2970 7.4399 118.5547 55.1033 42.2594 177.1020 127 I 3.9488 7.0323 111.2401 61.2391 38.8402 175.4453 128 N 4.4045 7.8494 122.4648 52.9550 37.2400 174.6326 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 2 S 8.19 4.23 0.00 3.95 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 3 E 7.76 3.67 0.00 2.19 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 2.22 2.29 0.00 4 E 8.21 4.04 0.00 1.88 2.03 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 2.42 2.46 0.00 5 A 7.05 2.00 0.65 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 6 L 6.93 3.92 0.00 1.80 1.70 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 K 7.71 4.08 0.00 1.99 1.96 0.00 1.89 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.72 7.81 8 W 7.93 4.52 0.00 3.56 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 9 G 7.86 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 10 E 8.20 4.06 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 11 S 7.40 4.61 0.00 4.18 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 12 L 7.66 2.84 0.00 0.27 1.07 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.18 3.97 0.00 1.95 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 2.30 2.44 0.00 14 K 7.82 4.18 0.00 1.90 1.94 0.00 1.78 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.90 7.81 15 L 7.82 3.95 0.00 1.82 1.48 0.44 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.60 3.96 0.00 1.62 1.43 -0.31 0.28 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 17 V 7.12 4.24 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 0.84 0.00 0.00 1.02 0.00 0.00 18 H 7.81 4.63 0.00 3.31 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.57 3.65 0.00 1.59 1.16 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.67 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.91 1.32 7.81 20 Y 7.86 4.33 0.00 3.53 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 21 G 7.75 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 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.61 3.80 0.00 1.96 1.65 0.89 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.57 3.96 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 24 V 7.71 3.67 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 1.26 0.00 0.00 25 F 8.21 3.39 0.00 2.35 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 26 Q 8.23 3.69 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 27 A 7.54 3.96 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 28 F 8.41 4.20 0.00 3.62 3.36 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 29 L 8.00 3.69 0.00 1.53 1.50 0.27 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.97 4.11 0.00 1.84 1.98 0.00 3.31 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.42 0.00 31 T 7.28 3.69 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 1.15 0.00 0.00 32 E 6.80 4.10 0.00 1.89 1.72 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 1.49 2.11 0.00 33 F 6.65 3.98 0.00 3.21 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 34 S 8.39 5.09 0.00 3.90 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 35 E 8.19 3.93 0.00 2.08 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 0.00 2.44 2.28 0.00 36 E 8.20 4.11 0.00 2.34 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 0.00 2.41 2.38 0.00 37 N 8.05 4.50 0.00 2.90 2.97 0.00 0.00 6.54 6.04 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 38 L 7.78 4.03 0.00 1.55 1.70 0.95 0.81 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 39 E 8.16 3.98 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 40 F 8.35 2.99 0.00 2.59 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 41 W 8.10 3.56 0.00 3.57 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.42 3.94 0.00 1.88 1.70 0.98 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.92 3.86 1.11 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 44 C 7.39 3.62 0.00 2.34 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.05 3.66 0.00 1.74 1.72 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 1.47 1.47 0.00 46 D 7.94 4.43 0.00 2.79 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 47 F 8.23 4.12 0.00 3.08 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 48 K 7.83 3.93 0.00 1.91 1.96 0.00 1.71 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.37 7.81 49 K 7.99 4.22 0.00 1.78 1.82 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.34 7.81 50 V 6.75 3.55 1.91 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 0.68 0.00 0.00 0.93 0.00 0.00 51 K 8.63 3.98 0.00 1.71 1.76 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.38 7.81 52 S 7.77 4.28 0.00 3.91 3.69 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 53 Q 8.73 3.91 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 54 S 7.99 4.15 0.00 4.10 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.13 4.01 0.00 1.98 1.90 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.48 7.81 56 M 8.86 4.06 0.00 2.03 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.18 0.00 57 A 8.26 4.09 1.38 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 58 S 8.20 4.19 0.00 4.14 4.17 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 59 K 8.54 4.03 0.00 2.07 2.33 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.77 7.81 60 A 8.65 4.27 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.12 4.05 0.00 2.13 1.92 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.53 7.81 62 K 8.72 4.00 0.00 2.00 1.93 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.72 7.81 63 I 8.32 3.91 1.80 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.94 0.54 0.00 0.00 64 F 8.56 4.04 0.00 3.47 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 65 A 7.96 4.02 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.00 3.98 0.00 1.78 1.58 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 1.47 1.85 0.00 67 Y 7.78 4.64 0.00 3.03 2.53 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 68 I 7.19 3.66 0.91 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.27 0.43 0.00 0.00 69 A 7.30 3.79 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 70 I 8.22 3.92 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.84 0.89 0.00 0.00 71 Q 9.10 3.56 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 72 A 7.58 4.09 1.19 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 0.00 0.00 73 C 8.66 4.15 0.00 2.86 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 74 K 7.58 4.60 0.00 1.37 1.67 0.00 1.40 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.15 7.81 75 E 8.28 4.11 0.00 2.03 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 2.20 2.24 0.00 76 V 8.26 4.09 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 0.65 0.00 0.00 0.42 0.00 0.00 77 N 8.66 4.55 0.00 2.66 2.76 0.00 0.00 6.87 7.78 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 78 L 7.76 4.75 0.00 1.57 1.50 0.81 1.13 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 79 D 8.29 4.76 0.00 3.02 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.51 4.12 0.00 3.95 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 81 Y 8.27 4.29 0.00 3.06 3.03 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 82 T 8.30 3.51 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 83 R 8.35 3.91 0.00 1.87 2.01 0.00 3.05 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 84 E 8.56 4.00 0.00 2.06 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 2.51 2.51 0.00 85 H 8.29 3.97 0.00 2.95 3.28 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 86 T 7.80 3.78 4.63 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 1.38 0.00 0.00 87 K 8.26 3.46 0.00 2.08 1.98 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.08 7.81 88 D 8.25 4.30 0.00 2.81 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 89 N 7.83 4.32 0.00 2.77 2.64 0.00 0.00 7.10 6.02 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 90 L 7.10 3.76 0.00 1.46 1.54 0.06 1.02 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 91 Q 7.67 4.29 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 7.08 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 92 S 7.23 4.46 0.00 3.55 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 93 V 7.98 3.65 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 1.15 0.00 0.00 0.94 0.00 0.00 94 T 8.06 4.76 4.25 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 1.20 0.00 0.00 95 R 8.53 4.26 0.00 1.79 2.00 0.00 3.10 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.39 0.00 96 G 7.89 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 C 7.80 3.63 0.00 2.84 2.57 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 98 F 7.73 4.85 0.00 2.99 2.96 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 0.00 0.00 0.00 99 D 8.09 4.43 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.94 3.96 0.00 1.62 1.54 0.98 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.10 4.12 1.69 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 0.00 0.00 102 Q 9.02 4.09 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.41 1.98 0.00 103 K 8.60 4.21 0.00 2.11 2.12 0.00 1.43 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.65 1.60 7.81 104 R 8.23 3.98 0.00 2.13 2.24 0.00 3.15 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 105 I 8.15 3.89 2.29 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 1.86 0.88 1.18 0.00 0.00 106 F 8.98 3.93 0.00 3.50 3.42 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 0.00 107 G 8.76 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 0.00 108 L 7.96 4.05 0.00 1.90 1.76 0.95 1.05 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 0.00 109 M 7.90 4.18 0.00 2.16 1.82 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.39 0.00 110 E 7.81 3.59 0.00 1.16 1.76 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 2.28 2.12 0.00 111 K 7.72 4.25 0.00 1.81 1.98 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 112 D 8.28 4.69 0.00 2.95 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 0.00 113 S 7.83 4.23 0.00 4.36 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 0.00 114 Y 8.37 4.10 0.00 2.92 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 0.00 115 P 0.00 3.94 0.00 2.02 2.02 0.00 3.89 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 116 R 7.56 4.01 0.00 2.10 2.26 0.00 3.28 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 117 F 8.18 2.71 0.00 2.75 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 0.00 118 L 7.05 3.36 0.00 1.42 1.39 0.25 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.15 4.24 0.00 1.87 1.92 0.00 3.12 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 120 S 7.15 4.52 0.00 4.18 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.78 4.33 0.00 2.83 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.09 4.05 0.00 1.86 2.02 1.06 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.96 4.14 0.00 1.45 2.43 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 0.00 0.00 0.00 0.00 124 L 8.23 3.61 0.00 1.57 1.55 0.90 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.22 4.44 0.00 2.67 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 0.00 126 L 7.44 4.30 0.00 1.57 1.47 1.26 0.87 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 0.00 127 I 7.03 3.95 1.62 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 0.94 0.33 0.35 0.00 0.00 128 N 7.85 4.40 0.00 2.75 2.74 0.00 0.00 5.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00